Naphthalenes
Brodifacoum, TRC
CAS: 56073-10-0 Molecular Formula: C31 H23 Br O3 Molecular Weight (g/mol): 523.42 Synonym: 3-[3-(4'-Bromo[1,1'-biphenyl]-4-yl)-1,2,3,4-tetrahydro-1-naphthalenyl]-4-hydroxy-2H-1-benzopyran-2-one,BFC,Brodifacoum,Brodimat,Brodimax Forte Pasta,Klerat,Klerat Block,Talon,Talon (rodenticide),Volid,WBA 8119 IUPAC Name: 3-[3-[4-(4-bromophenyl)phenyl]-1,2,3,4-tetrahydronaphthalen-1-yl]-4-hydroxychromen-2-one SMILES: OC1=C(C2CC(Cc3ccccc23)c4ccc(cc4)c5ccc(Br)cc5)C(=O)Oc6ccccc16
Lasofoxifene, TRC
CAS: 180916-16-9 Molecular Formula: C28 H31 N O2 Molecular Weight (g/mol): 413.55 Synonym: 2-Naphthalenol, 5,6,7,8-tetrahydro-6-phenyl-5-[4-[2-(1-pyrrolidinyl)ethoxy]phenyl]-, (5R,6S)-,2-Naphthalenol, 5,6,7,8-tetrahydro-6-phenyl-5-[4-[2-(1-pyrrolidinyl)ethoxy]phenyl]-, (5R-cis)-,(5R,6S)-5,6,7,8-Tetrahydro-6-phenyl-5-[4-[2-(1-pyrrolidinyl)ethoxy]phenyl]-2-naphthalenol,(-)-cis-6(S)-Phenyl-5(R)-[4-(2-pyrrolidin-1-ylethoxy)phenyl]-5,6,7,8-tetrahydronaphthalen-2-ol,Lasofoxifene IUPAC Name: (5R,6S)-6-phenyl-5-[4-(2-pyrrolidin-1-ylethoxy)phenyl]-5,6,7,8-tetrahydronaphthalen-2-ol SMILES: Oc1ccc2[C@H]([C@H](CCc2c1)c3ccccc3)c4ccc(OCCN5CCCC5)cc4
Dansylhydrazine, TRC
CAS: 33008-06-9 Molecular Formula: C12H15N3O2S Molecular Weight (g/mol): 265.33 Synonym: 1-Dimethylaminonaphthalene-5-sulfonyl Hydrazide,1-Dimethylaminonaphthalene-5-sulfonyl Hydrazide,5-(Dimethylamino)naphthalene-1-sulfonyl Hydrazide,Dansyl Hydrazide; IUPAC Name: 5-(dimethylamino)naphthalene-1-sulfonohydrazide SMILES: CN(C)c1cccc2c(cccc12)S(=O)(=O)NN
Buparvaquone, TRC
CAS: 88426-33-9 Molecular Formula: C21 H26 O3 Molecular Weight (g/mol): 326.43 Synonym: 2-[[4-(1,1-Dimethylethyl)cyclohexyl]methyl]-3-hydroxy-1,4-naphthalenedione,Buparvaquone,Butalex IUPAC Name: 2-[(4-tert-butylcyclohexyl)methyl]-3-hydroxynaphthalene-1,4-dione SMILES: CC(C)(C)C1CCC(CC2=C(O)C(=O)c3ccccc3C2=O)CC1
Difethialone, TRC
CAS: 104653-34-1 Molecular Formula: C31 H23 Br O2 S Molecular Weight (g/mol): 539.48 Synonym: 2H-1-Benzothiopyran-2-one, 3-[3-(4'-bromo[1,1'-biphenyl]-4-yl)-1,2,3,4-tetrahydro-1-naphthalenyl]-4-hydroxy-,3-[3-(4'-Bromo[1,1'-biphenyl]-4-yl)-1,2,3,4-tetrahydro-1-naphthalenyl]-4-hydroxy-2H-1-benzothiopyran-2-one,Baraki,Difethialone,Difethiarol,LM 2219 IUPAC Name: 3-[3-[4-(4-bromophenyl)phenyl]-1,2,3,4-tetrahydronaphthalen-1-yl]-4-hydroxythiochromen-2-one SMILES: OC1=C(C2CC(Cc3ccccc23)c4ccc(cc4)c5ccc(Br)cc5)C(=O)Sc6ccccc16
STF 083010, TRC
CAS: 307543-71-1 Molecular Formula: C15H11NO3S2 Molecular Weight (g/mol): 317.38 Synonym: STF 083010,N-[(2-Hydroxy-1-naphthalenyl)methylene]-2-thiophenesulfonamide IUPAC Name: (NE)-N-[(2-hydroxynaphthalen-1-yl)methylidene]thiophene-2-sulfonamide SMILES: Oc1ccc2ccccc2c1\C=N\S(=O)(=O)c3cccs3
2,6-Dichloronaphthalene, TRC
CAS: 2065-70-5 Molecular Formula: C10H6Cl2 Molecular Weight (g/mol): 197.06 Synonym: PCN 11 SMILES: Clc1ccc2cc(Cl)ccc2c1
Oxantel Pamoate, TRC
CAS: 68813-55-8 Molecular Formula: C23 H16 O6 . C13 H16 N2 O Molecular Weight (g/mol): 604.65 Synonym: 2-Naphthalenecarboxylic acid, 4,4'-methylenebis[3-hydroxy-, compd. with 3-[(1E)-2-(1,4,5,6-tetrahydro-1-methyl-2-pyrimidinyl)ethenyl]phenol (1:1),2-Naphthalenecarboxylic acid, 4,4'-methylenebis[3-hydroxy-, compd. with (E)-3-[2-(1,4,5,6-tetrahydro-1-methyl-2-pyrimidinyl)ethenyl]phenol (1:1),Phenol, 3-[(1E)-2-(1,4,5,6-tetrahydro-1-methyl-2-pyrimidinyl)ethenyl]-, 4,4'-methylenebis[3-hydroxy-2-naphthalenecarboxylate] (1:1) (salt) (9CI),Phenol, 3-[2-(1,4,5,6-tetrahydro-1-methyl-2-pyrimidinyl)ethenyl]-, (E)-, 4,4'-methylenebis[3-hydroxy-2-naphthalenecarboxylate] (1:1) (salt),CP 14445-16,Oxantel ebonate,Oxantel pamoate,Telopar IUPAC Name: 4-[(3-carboxy-2-hydroxynaphthalen-1-yl)methyl]-3-hydroxynaphthalene-2-carboxylic acid;3-[(E)-2-(1-methyl-5,6-dihydro-4H-pyrimidin-2-yl)ethenyl]phenol SMILES: CN1CCCN=C1\C=C\c2cccc(O)c2.OC(=O)c3cc4ccccc4c(Cc5c(O)c(cc6ccccc56)C(=O)O)c3O
1-Naphthol, TRC
CAS: 90-15-3 Molecular Formula: C10 H8 O Molecular Weight (g/mol): 144.17 Synonym: Naphthalen-1-ol,1-Naphthol,Duloxetine Hydrochloride Imp. D (Pharmeuropa),1-Naphthalenol,1-Naphthol (8CI),1-Hydroxynaphthalene,1-Naphthyl alcohol,BASF Ursol ERN,C.I. 76605,C.I. Oxidation Base 33,Durafur Developer D,Fouramine ERN,Fourrine 99,Fourrine ERN,Furro ER,NSC 9586,Nako TRB,Naphthol-1,Naphthyl-1-ol,Tertral ERN,Ursol ERN,Zoba ERN,α-Hydroxynaphthalene,α-Naphthol,α-Naphthyl alcohol IUPAC Name: naphthalen-1-ol SMILES: Oc1cccc2ccccc12
Dasabuvir, TRC
CAS: 1132935-63-7 Molecular Formula: C26 H27 N3 O5 S Molecular Weight (g/mol): 493.57 Synonym: Methanesulfonamide, N-[6-[5-(3,4-dihydro-2,4-dioxo-1(2H)-pyrimidinyl)-3-(1,1-dimethylethyl)-2-methoxyphenyl]-2-naphthalenyl]-,N-[6-[5-(3,4-Dihydro-2,4-dioxo-1(2H)-pyrimidinyl)-3-(1,1-dimethylethyl)-2-methoxyphenyl]-2-naphthalenyl]methanesulfonamide,ABT 333,Dasabuvir,N-[6-[3-tert-Butyl-5-(2,4-dioxo-3,4-dihydropyrimidin-1(2H)-yl)-2-methoxyphenyl]naphthalen-2-yl]methanesulfonamide IUPAC Name: N-[6-[3-tert-butyl-5-(2,4-dioxopyrimidin-1-yl)-2-methoxyphenyl]naphthalen-2-yl]methanesulfonamide SMILES: COc1c(cc(cc1C(C)(C)C)N2C=CC(=O)NC2=O)c3ccc4cc(NS(=O)(=O)C)ccc4c3
Tetraxolin, TRC
CAS: 100343-43-9 Molecular Formula: C10 H8 O6 Molecular Weight (g/mol): 224.167 Synonym: 2,3-Dihydro-2,2,3,3-tetrahydroxy-1,4-naphthalenedione;2,2,3,3-Tetrahydroxynaphthalene-1,4-dione;Oksolin,Oxolin,Oxoline; IUPAC Name: 2,2,3,3-tetrahydroxytetralin-1,4-dione SMILES: OC1(O)C(=O)c2ccccc2C(=O)C1(O)O
1,2-Dihydroxynaphthalene, TRC
CAS: 574-00-5 Molecular Formula: C10H8O2 Molecular Weight (g/mol): 160.17 Synonym: 1,2-Naphthalenediol,1,2-Naphthoquinol,1-Hydroxy-2-naphthol,NSC 401609 SMILES: Oc1ccc2ccccc2c1O
Toluidine Red, TRC
CAS: 2425-85-6 Molecular Formula: C17 H13 N3 O3 Molecular Weight (g/mol): 307.3 Synonym: 2-Naphthalenol, 1-[2-(4-methyl-2-nitrophenyl)diazenyl]- (ACI),1-[2-(4-Methyl-2-nitrophenyl)diazenyl]-2-naphthalenol (ACI),2-Naphthalenol, 1-[(4-methyl-2-nitrophenyl)azo]- (9CI),C.I. Pigment Red 3 (7CI, 8CI),Toluidine red (6CI),1-((4-Methyl-2-nitrophenyl)diazenyl)naphthalen-2-ol,1-(4-Methyl-2-nitrophenylazo)-2-naphthol,1-(o-Nitro-p-tolylazo)-2-naphthol,1-[(2-Nitro-4-methylphenyl)azo]-2-naphthol,2-Nitro-p-toluidine-2-naphthol,Accosperse Toluidine Red XL,ADC Toluidine Red B,Atlasol Spirit Red 3,C.I. 12120,C.P. Toluidine Toner A 2989,C.P. Toluidine Toner A 2990,C.P. Toluidine Toner Dark RS 3340,C.P. Toluidine Toner Deep X 1865,C.P. Toluidine Toner Light RS 3140,C.P. Toluidine Toner RT 6101,C.P. Toluidine Toner RT 6104,Calcotone Toluidine Red YP,Carnelio Helio Red,Chromatex Red J,D and C Red No. 35,Dainichi Permanent Red 4R,Deep Fastona Red,Duplex Toluidine Red L 20-3140,Eljon Fast Scarlet PV Extra,Eljon Fast Scarlet RN,Enialit Light Red RL,Fast Red A,Fast Red A (pigment),Fast Red AB,Fast Red J,Fast Red JE,Fast Red R,Fastona Red B,Fastona Scarlet RL,Fastona Scarlet YS,Graphtol Red A 4RL,Hansa Red B,Hansa Red G,Hansa Scarlet RB,Hansa Scarlet RN,Hansa Scarlet RNC,Helio Fast Red BN,Helio Fast Red RL,Helio Fast Red RN,Helio Red RL,Helio Red Toner,Hispalit Fast Scarlet RN,Independence Red,Irgalite Fast Red P 4R,Irgalite Fast Scarlet RND,Irgalite Red PV 2,Irgalite Red RNPX,Irgalite Scarlet RB,Isol Fast Red HB,Isol Fast Red RN 2B,Isol Fast Red RN 2G,Isol Fast Red RNB,Isol Fast Red RNG,Isol Toluidine Red HB,Isol Toluidine Red RN 2B,Isol Toluidine Red RN 2G,Isol Toluidine Red RNB,Isol Toluidine Red RNG,Japan Red 221,Japan Red No. 221,Kromon Helio Fast Red,Kromon Helio Fast Red YS,Lake Red 4R,Lake Red 4RII,Lithol Fast Scarlet RN,Lutetia Fast Red 3R,Lutetia Fast Scarlet RF,Lutetia Fast Scarlet RJN,Monolite Fast Scarlet CA,Monolite Fast Scarlet GSA,Monolite Fast Scarlet RB,Monolite Fast Scarlet RBA,Monolite Fast Scarlet RN,Monolite Fast Scarlet RNA,Monolite Fast Scarlet RNV,Monolite Fast Scarlet RT,No. 2 Forthfast Scarlet,NSC 45193,Oralith Red P 4R,Permanent Red 4R,Pigment Red 3,Pigment Red RL,Pigment Scarlet,Pigment Scarlet (Russian),Pigment Scarlet B,Pigment Scarlet Conc.,Pigment Scarlet N,Pigment Scarlet R,Polymo Red FGN,Recolite Fast Red RBL,Recolite Fast Red RL,Recolite Fast Red RYL,Red No. 221,Sanyo Scarlet Pure,Sanyo Scarlet Pure No. 1000,Scarlet Pigment RN,Segnale Light Red 2B,Segnale Light Red B,Segnale Light Red BR,Segnale Light Red C 4R,Segnale Light Red RL,Seikafast Red 4R4016,Sico Red L 3750,Siegle Red 1,Siegle Red B,Siegle Red BB,Silogomma Red RLL,Silosol Red RBN,Silosol Red RN,Siloton Red BRLL,Siloton Red RLL,Symuler Fast Red 4R100,Symuler Fast Scarlet 4R,Syton Fast Scarlet RB,Syton Fast Scarlet RD,Syton Fast Scarlet RN,Tertropigment Red HAB,Tertropigment Scarlet LRN,Toluidene Red,Toluidine Red 10451,Toluidine Red 3B,Toluidine Red 4R,Toluidine Red B,Toluidine Red BFB,Toluidine Red BFGG,Toluidine Red D 28-3930,Toluidine Red Light,Toluidine Red M 20-3785,Toluidine Red R,Toluidine Red RB 0336C,Toluidine Red RT 115,Toluidine Red Toner,Toluidine Red XL 20-3050,Toluidine Toner,Toluidine Toner Dark 5040,Toluidine Toner HR-X 2700,Toluidine Toner HR-X 2741,Toluidine Toner Keep HR-X 2742,Toluidine Toner L 20-3300,Toluidine Toner RT 252,Versal Scarlet PRNL,Versal Scarlet RNL,Vulcafor Scarlet A IUPAC Name: 1-[(E)-(4-methyl-2-nitrophenyl)diazenyl]naphthalen-2-ol SMILES: Cc1ccc(N=Nc2c(O)ccc3ccccc23)c(c1)[N+](=O)[O-]
Flavianic Acid, TRC
CAS: 483-84-1 Molecular Formula: C10H6N2O8S Molecular Weight (g/mol): 314.23 SMILES: Oc1c(cc(c2ccc(cc12)S(=O)(=O)O)[N+](=O)[O-])[N+](=O)[O-]
2-Naphthol, TRC
CAS: 135-19-3 Molecular Formula: C10 H8 O Molecular Weight (g/mol): 144.17 Synonym: Naphthalen-2-ol,Tolnaftate Imp. A (EP),beta-Naphthol,2-Naphthalenol,2-Naphthol (8CI),2-Hydroxynaphthalene,Azogen Developer A,Betanaphthol,Bordeaux Base GP,C.I. 37500,C.I. Azoic Coupling Component 1,C.I. Developer 5,Developer A,Developer AMS,Developer BN,Developer NA,Isonaphthol,NSC 2044,NSC 5737,Naphthol B,β-Hydroxynaphthalene,β-Naphthol,β-Naphthyl alcohol IUPAC Name: naphthalen-2-ol SMILES: Oc1ccc2ccccc2c1