CAS RN: 719-41-5
CAS Name: 1-hydroxy-9-xanthenone
OPENEYE Name: 1-hydroxyxanthen-9-one
IUPAC Name: 1-hydroxyxanthen-9-one
SYSTEMATIC NAME: 1-oxidanylxanthen-9-one
MOLECULAR FORMULA: C13H8O3
MOLECULAR WEIGHT: 212.20082
SMILES: C1=CC=C2C(=C1)C(=O)C3=C(O2)C=CC=C3O
Structure:
CAS RN: 3589-72-8
CAS Name: 6-methoxy-1-methyl-9H-pyrido[3,4-b]indole
OPENEYE Name: 6-methoxy-1-methyl-9H-pyrido[3,4-b]indole
IUPAC Name: 6-methoxy-1-methyl-9H-pyrido[3,4-b]indole
SYSTEMATIC NAME: 6-methoxy-1-methyl-9H-pyrido[3,4-b]indole
MOLECULAR FORMULA: C13H12N2O
MOLECULAR WEIGHT: 212.24718
SMILES: CC1=NC=CC2=C1NC3=C2C=C(C=C3)OC
Structure:
CAS RN: 7005-03-0
CAS Name: acetic acid [(E)-2-acetyloxy-1,2-diphenylethenyl] ester
OPENEYE Name: [(E)-2-acetoxy-1,2-diphenyl-vinyl] acetate
IUPAC Name: [(E)-2-acetyloxy-1,2-diphenylethenyl] acetate
SYSTEMATIC NAME: [(E)-2-acetyloxy-1,2-diphenyl-ethenyl] ethanoate
MOLECULAR FORMULA: C18H16O4
MOLECULAR WEIGHT: 296.31724
SMILES: CC(=O)O/C(=C(\C1=CC=CC=C1)/OC(=O)C)/C2=CC=CC=C2
Structure:
CAS RN: 29790-47-4
CAS Name: 2-[(2E,6E,10E,14E,18E,22E,26E)-3,7,11,15,19,23,27,31-octamethyldotriaconta-2,6,10,14,18,22,26,30-octaenyl]naphthalene-1,4-dione
OPENEYE Name: 2-[(2E,6E,10E,14E,18E,22E,26E)-3,7,11,15,19,23,27,31-octamethyldotriaconta-2,6,10,14,18,22,26,30-octaenyl]naphthalene-1,4-dione
IUPAC Name: 2-[(2E,6E,10E,14E,18E,22E,26E)-3,7,11,15,19,23,27,31-octamethyldotriaconta-2,6,10,14,18,22,26,30-octaenyl]naphthalene-1,4-dione
SYSTEMATIC NAME: 2-[(2E,6E,10E,14E,18E,22E,26E)-3,7,11,15,19,23,27,31-octamethyldotriaconta-2,6,10,14,18,22,26,30-octaenyl]naphthalene-1,4-dione
MOLECULAR FORMULA: C50H70O2
MOLECULAR WEIGHT: 703.0896
SMILES: CC(=CCC/C(=C/CC/C(=C/CC/C(=C/CC/C(=C/CC/C(=C/CC/C(=C/CC/C(=C/CC1=CC(=O)C2=CC=CC=C2C1=O)/C)/C)/C)/C)/C)/C)/C)C
Structure:
CAS RN: 18951-43-4
CAS Name: 4-[(E)-2-(4-aminophenyl)ethenyl]phenol
OPENEYE Name: 4-[(E)-2-(4-aminophenyl)vinyl]phenol
IUPAC Name: 4-[(E)-2-(4-aminophenyl)ethenyl]phenol
SYSTEMATIC NAME: 4-[(E)-2-(4-aminophenyl)ethenyl]phenol
MOLECULAR FORMULA: C14H13NO
MOLECULAR WEIGHT: 211.25912
SMILES: C1=CC(=CC=C1/C=C/C2=CC=C(C=C2)O)N
Structure:
CAS RN: 16691-28-4
CAS Name: N'-[anilino(sulfanylidene)methyl]carbamimidothioic acid methyl ester
OPENEYE Name: (1Z)-1-[amino(methylsulfanyl)methylene]-3-phenyl-thiourea
IUPAC Name: methyl N'-(phenylcarbamothioyl)carbamimidothioate
SYSTEMATIC NAME: methyl N'-(phenylcarbamothioyl)carbamimidothioate
MOLECULAR FORMULA: C9H11N3S2
MOLECULAR WEIGHT: 225.33374
SMILES: CS/C(=N\C(=S)NC1=CC=CC=C1)/N
Structure:
CAS RN: 40276-11-7
CAS Name: 1,4-dimethoxy-2-[(E)-2-nitroethenyl]benzene
OPENEYE Name: 1,4-dimethoxy-2-[(E)-2-nitrovinyl]benzene
IUPAC Name: 1,4-dimethoxy-2-[(E)-2-nitroethenyl]benzene
SYSTEMATIC NAME: 1,4-dimethoxy-2-[(E)-2-nitroethenyl]benzene
MOLECULAR FORMULA: C10H11NO4
MOLECULAR WEIGHT: 209.19864
SMILES: COC1=CC(=C(C=C1)OC)/C=C/[N+](=O)[O-]
Structure:
CAS RN: 51146-74-8
CAS Name: [(E)-(3-methoxyphenyl)methylideneamino]thiourea
OPENEYE Name: [(E)-(3-methoxyphenyl)methyleneamino]thiourea
IUPAC Name: [(E)-(3-methoxyphenyl)methylideneamino]thiourea
SYSTEMATIC NAME: 1-[(E)-(3-methoxyphenyl)methylideneamino]thiourea
MOLECULAR FORMULA: C9H11N3OS
MOLECULAR WEIGHT: 209.26814
SMILES: COC1=CC=CC(=C1)/C=N/NC(=S)N
Structure:
CAS RN: 10311-74-7
CAS Name: 1-methyl-2-[(E)-2-(2-methylphenyl)ethenyl]benzene
OPENEYE Name: 1-methyl-2-[(E)-2-(o-tolyl)vinyl]benzene
IUPAC Name: 1-methyl-2-[(E)-2-(2-methylphenyl)ethenyl]benzene
SYSTEMATIC NAME: 1-methyl-2-[(E)-2-(2-methylphenyl)ethenyl]benzene
MOLECULAR FORMULA: C16H16
MOLECULAR WEIGHT: 208.29824
SMILES: CC1=CC=CC=C1/C=C/C2=CC=CC=C2C
Structure:
CAS RN: 36888-18-3
CAS Name: 1-methyl-2-[(E)-2-(2-methylphenyl)ethenyl]benzene
OPENEYE Name: 1-methyl-2-[(E)-2-(o-tolyl)vinyl]benzene
IUPAC Name: 1-methyl-2-[(E)-2-(2-methylphenyl)ethenyl]benzene
SYSTEMATIC NAME: 1-methyl-2-[(E)-2-(2-methylphenyl)ethenyl]benzene
MOLECULAR FORMULA: C16H16
MOLECULAR WEIGHT: 208.29824
SMILES: CC1=CC=CC=C1/C=C/C2=CC=CC=C2C
Structure:
CAS RN: 32555-96-7
CAS Name: 4-[(E)-2-phenylethenyl]benzaldehyde
OPENEYE Name: 4-[(E)-styryl]benzaldehyde
IUPAC Name: 4-[(E)-2-phenylethenyl]benzaldehyde
SYSTEMATIC NAME: 4-[(E)-2-phenylethenyl]benzaldehyde
MOLECULAR FORMULA: C15H12O
MOLECULAR WEIGHT: 208.25518
SMILES: C1=CC=C(C=C1)/C=C/C2=CC=C(C=C2)C=O
Structure:
CAS RN: 4224-87-7
CAS Name: (E)-3-(4-methylphenyl)-1-phenyl-2-propen-1-one
OPENEYE Name: (E)-1-phenyl-3-(p-tolyl)prop-2-en-1-one
IUPAC Name: (E)-3-(4-methylphenyl)-1-phenylprop-2-en-1-one
SYSTEMATIC NAME: (E)-3-(4-methylphenyl)-1-phenyl-prop-2-en-1-one
MOLECULAR FORMULA: C16H14O
MOLECULAR WEIGHT: 222.28176
SMILES: CC1=CC=C(C=C1)/C=C/C(=O)C2=CC=CC=C2
Structure:
CAS RN: 6689-41-4
CAS Name: [2-methoxy-4-[(E)-prop-1-enyl]phenoxy]-trimethylsilane
OPENEYE Name: [2-methoxy-4-[(E)-prop-1-enyl]phenoxy]-trimethyl-silane
IUPAC Name: [2-methoxy-4-[(E)-prop-1-enyl]phenoxy]-trimethylsilane
SYSTEMATIC NAME: [2-methoxy-4-[(E)-prop-1-enyl]phenoxy]-trimethyl-silane
MOLECULAR FORMULA: C13H20O2Si
MOLECULAR WEIGHT: 236.3822
SMILES: C/C=C/C1=CC(=C(C=C1)O[Si](C)(C)C)OC
Structure:
CAS RN: 10193-62-1
CAS Name: 1-azido-4-[(E)-2-(4-azidophenyl)ethenyl]benzene
OPENEYE Name: 1-azido-4-[(E)-2-(4-azidophenyl)vinyl]benzene
IUPAC Name: 1-azido-4-[(E)-2-(4-azidophenyl)ethenyl]benzene
SYSTEMATIC NAME: 1-azido-4-[(E)-2-(4-azidophenyl)ethenyl]benzene
MOLECULAR FORMULA: C14H10N6
MOLECULAR WEIGHT: 262.2694
SMILES: C1=CC(=CC=C1/C=C/C2=CC=C(C=C2)N=[N+]=[N-])N=[N+]=[N-]
Structure:
CAS RN: 18004-57-4
CAS Name: (9E)-9-anthracenecarboxaldehyde oxime
OPENEYE Name: (9E)-anthracene-9-carbaldehyde oxime
IUPAC Name: (NE)-N-(anthracen-9-ylmethylidene)hydroxylamine
SYSTEMATIC NAME: (NE)-N-(anthracen-9-ylmethylidene)hydroxylamine
MOLECULAR FORMULA: C15H11NO
MOLECULAR WEIGHT: 221.25394
SMILES: C1=CC=C2C(=C1)C=C3C=CC=CC3=C2/C=N/O
Structure:
CAS RN: 6720-37-2
CAS Name: (E)-3-(3-nitrophenyl)-2-phenyl-2-propenenitrile
OPENEYE Name: (E)-3-(3-nitrophenyl)-2-phenyl-prop-2-enenitrile
IUPAC Name: (E)-3-(3-nitrophenyl)-2-phenylprop-2-enenitrile
SYSTEMATIC NAME: (E)-3-(3-nitrophenyl)-2-phenyl-prop-2-enenitrile
MOLECULAR FORMULA: C15H10N2O2
MOLECULAR WEIGHT: 250.2521
SMILES: C1=CC=C(C=C1)/C(=C\C2=CC(=CC=C2)[N+](=O)[O-])/C#N
Structure:
CAS RN: 262-89-5
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C16H12
MOLECULAR WEIGHT: 204.26648
SMILES: C1=CC=C/2C(=C1)/C=C\C3=CC=CC=C3/C=C2
Structure:
CAS RN: 29366-78-7
CAS Name: (6Z)-6-(4,6-diamino-1H-1,3,5-triazin-2-ylidene)-1-cyclohexa-2,4-dienone
OPENEYE Name: (6Z)-6-(4,6-diamino-1H-1,3,5-triazin-2-ylidene)cyclohexa-2,4-dien-1-one
IUPAC Name: (6Z)-6-(4,6-diamino-1H-1,3,5-triazin-2-ylidene)cyclohexa-2,4-dien-1-one
SYSTEMATIC NAME: (6Z)-6-[4,6-bis(azanyl)-1H-1,3,5-triazin-2-ylidene]cyclohexa-2,4-dien-1-one
MOLECULAR FORMULA: C9H9N5O
MOLECULAR WEIGHT: 203.20066
SMILES: C1=C/C(=C/2\NC(=NC(=N2)N)N)/C(=O)C=C1
Structure:
CAS RN: 575-03-1
CAS Name: 7-hydroxy-4-(trifluoromethyl)-1-benzopyran-2-one
OPENEYE Name: 7-hydroxy-4-(trifluoromethyl)chromen-2-one
IUPAC Name: 7-hydroxy-4-(trifluoromethyl)chromen-2-one
SYSTEMATIC NAME: 7-oxidanyl-4-(trifluoromethyl)chromen-2-one
MOLECULAR FORMULA: C10H5F3O3
MOLECULAR WEIGHT: 230.14011
SMILES: C1=CC2=C(C=C1O)OC(=O)C=C2C(F)(F)F
Structure:
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