CAS RN: 7461-72-5
CAS Name: acetic acid [4-acetyloxy-2-(2,5-diacetyloxy-4-methoxyphenyl)-5-methoxyphenyl] ester
OPENEYE Name: [4-acetoxy-2-(2,5-diacetoxy-4-methoxy-phenyl)-5-methoxy-phenyl] acetate
IUPAC Name: [4-acetyloxy-2-(2,5-diacetyloxy-4-methoxyphenyl)-5-methoxyphenyl] acetate
SYSTEMATIC NAME: [4-acetyloxy-2-(2,5-diacetyloxy-4-methoxy-phenyl)-5-methoxy-phenyl] ethanoate
MOLECULAR FORMULA: C22H22O10
MOLECULAR WEIGHT: 446.40408
SMILES: CC(=O)OC1=CC(=C(C=C1C2=CC(=C(C=C2OC(=O)C)OC)OC(=O)C)OC(=O)C)OC
Structure:
CAS RN: 7461-71-4
CAS Name: 2,2-diphenyl-4-propyl-1,3-benzodioxole
OPENEYE Name: 2,2-diphenyl-4-propyl-1,3-benzodioxole
IUPAC Name: 2,2-diphenyl-4-propyl-1,3-benzodioxole
SYSTEMATIC NAME: 2,2-diphenyl-4-propyl-1,3-benzodioxole
MOLECULAR FORMULA: C22H20O2
MOLECULAR WEIGHT: 316.393
SMILES: CCCC1=C2C(=CC=C1)OC(O2)(C3=CC=CC=C3)C4=CC=CC=C4
Structure:
CAS RN: 7461-70-3
CAS Name: N-[3-[(6-methoxy-4-quinolinyl)methylidene]cyclohexyl]acetamide
OPENEYE Name: N-[3-[(6-methoxy-4-quinolyl)methylene]cyclohexyl]acetamide
IUPAC Name: N-[3-[(6-methoxyquinolin-4-yl)methylidene]cyclohexyl]acetamide
SYSTEMATIC NAME: N-[3-[(6-methoxyquinolin-4-yl)methylidene]cyclohexyl]ethanamide
MOLECULAR FORMULA: C19H22N2O2
MOLECULAR WEIGHT: 310.39018
SMILES: CC(=O)NC1CCCC(=CC2=C3C=C(C=CC3=NC=C2)OC)C1
Structure:
CAS RN: 7461-69-0
CAS Name: N-[3-[(6-methoxy-4-quinolinyl)methylidene]-4-oxocyclohexyl]acetamide
OPENEYE Name: N-[3-[(6-methoxy-4-quinolyl)methylene]-4-oxo-cyclohexyl]acetamide
IUPAC Name: N-[3-[(6-methoxyquinolin-4-yl)methylidene]-4-oxocyclohexyl]acetamide
SYSTEMATIC NAME: N-[3-[(6-methoxyquinolin-4-yl)methylidene]-4-oxidanylidene-cyclohexyl]ethanamide
MOLECULAR FORMULA: C19H20N2O3
MOLECULAR WEIGHT: 324.3737
SMILES: CC(=O)NC1CCC(=O)C(=CC2=C3C=C(C=CC3=NC=C2)OC)C1
Structure:
CAS RN: 7461-68-9
CAS Name: N-phenylcarbamic acid 3-(2,3-dimethoxyphenyl)propyl ester
OPENEYE Name: 3-(2,3-dimethoxyphenyl)propyl N-phenylcarbamate
IUPAC Name: 3-(2,3-dimethoxyphenyl)propyl N-phenylcarbamate
SYSTEMATIC NAME: 3-(2,3-dimethoxyphenyl)propyl N-phenylcarbamate
MOLECULAR FORMULA: C18H21NO4
MOLECULAR WEIGHT: 315.36364
SMILES: COC1=CC=CC(=C1OC)CCCOC(=O)NC2=CC=CC=C2
Structure:
CAS RN: 7461-67-8
CAS Name: 6-methoxy-4-[2-(2-nitrophenyl)ethenyl]quinoline
OPENEYE Name: 6-methoxy-4-[2-(2-nitrophenyl)vinyl]quinoline
IUPAC Name: 6-methoxy-4-[2-(2-nitrophenyl)ethenyl]quinoline
SYSTEMATIC NAME: 6-methoxy-4-[2-(2-nitrophenyl)ethenyl]quinoline
MOLECULAR FORMULA: C18H14N2O3
MOLECULAR WEIGHT: 306.31536
SMILES: COC1=CC2=C(C=CN=C2C=C1)C=CC3=CC=CC=C3[N+](=O)[O-]
Structure:
CAS RN: 7461-66-7
CAS Name: 4,5-dianilinocyclohexa-3,5-diene-1,2-dione
OPENEYE Name: 4,5-dianilino-1,2-benzoquinone
IUPAC Name: 4,5-dianilinocyclohexa-3,5-diene-1,2-dione
SYSTEMATIC NAME: 4,5-bis(phenylazanyl)cyclohexa-3,5-diene-1,2-dione
MOLECULAR FORMULA: C18H14N2O2
MOLECULAR WEIGHT: 290.31596
SMILES: C1=CC=C(C=C1)NC2=CC(=O)C(=O)C=C2NC3=CC=CC=C3
Structure:
CAS RN: 7461-65-6
CAS Name: 4-acetamidobenzoic acid cyclohexyl ester
OPENEYE Name: cyclohexyl 4-acetamidobenzoate
IUPAC Name: cyclohexyl 4-acetamidobenzoate
SYSTEMATIC NAME: cyclohexyl 4-acetamidobenzoate
MOLECULAR FORMULA: C15H19NO3
MOLECULAR WEIGHT: 261.31626
SMILES: CC(=O)NC1=CC=C(C=C1)C(=O)OC2CCCCC2
Structure:
CAS RN: 7461-64-5
CAS Name: 4-methyl-6-nitro-2-(1-piperidinyl)quinoline
OPENEYE Name: 4-methyl-6-nitro-2-(1-piperidyl)quinoline
IUPAC Name: 4-methyl-6-nitro-2-piperidin-1-ylquinoline
SYSTEMATIC NAME: 4-methyl-6-nitro-2-piperidin-1-yl-quinoline
MOLECULAR FORMULA: C15H17N3O2
MOLECULAR WEIGHT: 271.31438
SMILES: CC1=CC(=NC2=C1C=C(C=C2)[N+](=O)[O-])N3CCCCC3
Structure:
CAS RN: 7508-68-1
CAS Name: 4-phenyldiazenylbenzoic acid ethyl ester
OPENEYE Name: ethyl 4-phenylazobenzoate
IUPAC Name: ethyl 4-phenyldiazenylbenzoate
SYSTEMATIC NAME: ethyl 4-phenyldiazenylbenzoate
MOLECULAR FORMULA: C15H14N2O2
MOLECULAR WEIGHT: 254.28386
SMILES: CCOC(=O)C1=CC=C(C=C1)N=NC2=CC=CC=C2
Structure:
CAS RN: 7461-62-3
CAS Name: dibenzofuran-2,3,7,8-tetrol
OPENEYE Name: dibenzofuran-2,3,7,8-tetrol
IUPAC Name: dibenzofuran-2,3,7,8-tetrol
SYSTEMATIC NAME: dibenzofuran-2,3,7,8-tetrol
MOLECULAR FORMULA: C12H8O5
MOLECULAR WEIGHT: 232.18892
SMILES: C1=C2C3=CC(=C(C=C3OC2=CC(=C1O)O)O)O
Structure:
CAS RN: 2057-84-3
CAS Name: 2,4-dinitro-N-(pentylideneamino)aniline
OPENEYE Name: 2,4-dinitro-N-(pentylideneamino)aniline
IUPAC Name: 2,4-dinitro-N-(pentylideneamino)aniline
SYSTEMATIC NAME: 2,4-dinitro-N-(pentylideneamino)aniline
MOLECULAR FORMULA: C11H14N4O4
MOLECULAR WEIGHT: 266.25326
SMILES: CCCCC=NNC1=C(C=C(C=C1)[N+](=O)[O-])[N+](=O)[O-]
Structure:
CAS RN: 86-68-0
CAS Name: 6-methoxy-4-quinolinecarboxylic acid
OPENEYE Name: 6-methoxyquinoline-4-carboxylic acid
IUPAC Name: 6-methoxyquinoline-4-carboxylic acid
SYSTEMATIC NAME: 6-methoxyquinoline-4-carboxylic acid
MOLECULAR FORMULA: C11H9NO3
MOLECULAR WEIGHT: 203.19406
SMILES: COC1=CC2=C(C=CN=C2C=C1)C(=O)O
Structure:
CAS RN: 7461-57-6
CAS Name: N4,N4-dimethylcyclohexane-1,4-diamine; 2,4,6-trinitrophenol
OPENEYE Name: N4,N4-dimethylcyclohexane-1,4-diamine; picric acid
IUPAC Name: 4-N,4-N-dimethylcyclohexane-1,4-diamine; 2,4,6-trinitrophenol
SYSTEMATIC NAME: N4,N4-dimethylcyclohexane-1,4-diamine; 2,4,6-trinitrophenol
MOLECULAR FORMULA: C14H21N5O7
MOLECULAR WEIGHT: 371.34584
SMILES: CN(C)C1CCC(CC1)N.C1=C(C=C(C(=C1[N+](=O)[O-])O)[N+](=O)[O-])[N+](=O)[O-]
Structure:
CAS RN: 7461-56-5
CAS Name: 3-chloro-N,N-dimethyl-1-cyclohexanamine; 2,4,6-trinitrophenol
OPENEYE Name: 3-chloro-N,N-dimethyl-cyclohexanamine; picric acid
IUPAC Name: 3-chloro-N,N-dimethylcyclohexan-1-amine; 2,4,6-trinitrophenol
SYSTEMATIC NAME: 3-chloranyl-N,N-dimethyl-cyclohexan-1-amine; 2,4,6-trinitrophenol
MOLECULAR FORMULA: C14H19ClN4O7
MOLECULAR WEIGHT: 390.77626
SMILES: CN(C)C1CCCC(C1)Cl.C1=C(C=C(C(=C1[N+](=O)[O-])O)[N+](=O)[O-])[N+](=O)[O-]
Structure:
CAS RN: 7461-55-4
CAS Name: 1-bromo-2,3-dimethoxy-5-nitrobenzene
OPENEYE Name: 1-bromo-2,3-dimethoxy-5-nitro-benzene
IUPAC Name: 1-bromo-2,3-dimethoxy-5-nitrobenzene
SYSTEMATIC NAME: 1-bromanyl-2,3-dimethoxy-5-nitro-benzene
MOLECULAR FORMULA: C8H8BrNO4
MOLECULAR WEIGHT: 262.05742
SMILES: COC1=C(C(=CC(=C1)[N+](=O)[O-])Br)OC
Structure:
CAS RN: 701-41-7
CAS Name: 6-fluoro-2-pyridinecarbohydrazide
OPENEYE Name: 6-fluoropyridine-2-carbohydrazide
IUPAC Name: 6-fluoropyridine-2-carbohydrazide
SYSTEMATIC NAME: 6-fluoranylpyridine-2-carbohydrazide
MOLECULAR FORMULA: C6H6FN3O
MOLECULAR WEIGHT: 155.129743
SMILES: C1=CC(=NC(=C1)F)C(=O)NN
Structure:
CAS RN: 1480-65-5
CAS Name: 5-chloro-2-fluoropyridine
OPENEYE Name: 5-chloro-2-fluoro-pyridine
IUPAC Name: 5-chloro-2-fluoropyridine
SYSTEMATIC NAME: 5-chloranyl-2-fluoranyl-pyridine
MOLECULAR FORMULA: C5H3ClFN
MOLECULAR WEIGHT: 131.535423
SMILES: C1=CC(=NC=C1Cl)F
Structure:
CAS RN: 7471-44-5
CAS Name: 8-phenylbenzo[a]anthracene-7,12-dione
OPENEYE Name: 8-phenylbenzo[a]anthracene-7,12-dione
IUPAC Name: 8-phenylbenzo[a]anthracene-7,12-dione
SYSTEMATIC NAME: 8-phenylbenzo[a]anthracene-7,12-dione
MOLECULAR FORMULA: C24H14O2
MOLECULAR WEIGHT: 334.36676
SMILES: C1=CC=C(C=C1)C2=C3C(=CC=C2)C(=O)C4=C(C3=O)C=CC5=CC=CC=C54
Structure:
CAS RN: 7471-43-4
CAS Name: 5,9-dimethoxy-1-(2-methoxy-2-oxoethyl)-2-methyl-3,4-dihydro-1H-phenanthrene-2-carboxylic acid methyl ester
OPENEYE Name: methyl 5,9-dimethoxy-1-(2-methoxy-2-oxo-ethyl)-2-methyl-3,4-dihydro-1H-phenanthrene-2-carboxylate
IUPAC Name: methyl 5,9-dimethoxy-1-(2-methoxy-2-oxoethyl)-2-methyl-3,4-dihydro-1H-phenanthrene-2-carboxylate
SYSTEMATIC NAME: methyl 5,9-dimethoxy-1-(2-methoxy-2-oxidanylidene-ethyl)-2-methyl-3,4-dihydro-1H-phenanthrene-2-carboxylate
MOLECULAR FORMULA: C22H26O6
MOLECULAR WEIGHT: 386.43824
SMILES: CC1(CCC2=C3C(=C(C=C2C1CC(=O)OC)OC)C=CC=C3OC)C(=O)OC
Structure:
CAS RN: 7494-66-8
CAS Name: 2-(5,9-dimethoxy-2-methoxycarbonyl-2-methyl-3,4-dihydro-1H-phenanthren-1-yl)acetic acid
OPENEYE Name: 2-(5,9-dimethoxy-2-methoxycarbonyl-2-methyl-3,4-dihydro-1H-phenanthren-1-yl)acetic acid
IUPAC Name: 2-(5,9-dimethoxy-2-methoxycarbonyl-2-methyl-3,4-dihydro-1H-phenanthren-1-yl)acetic acid
SYSTEMATIC NAME: 2-(5,9-dimethoxy-2-methoxycarbonyl-2-methyl-3,4-dihydro-1H-phenanthren-1-yl)ethanoic acid
MOLECULAR FORMULA: C21H24O6
MOLECULAR WEIGHT: 372.41166
SMILES: CC1(CCC2=C3C(=C(C=C2C1CC(=O)O)OC)C=CC=C3OC)C(=O)OC
Structure:
CAS RN: 7471-42-3
CAS Name: 1-hydroxy-1-(2-methoxy-2-oxoethyl)-2-methyl-3,4-dihydrophenanthrene-2-carboxylic acid methyl ester
OPENEYE Name: methyl 1-hydroxy-1-(2-methoxy-2-oxo-ethyl)-2-methyl-3,4-dihydrophenanthrene-2-carboxylate
IUPAC Name: methyl 1-hydroxy-1-(2-methoxy-2-oxoethyl)-2-methyl-3,4-dihydrophenanthrene-2-carboxylate
SYSTEMATIC NAME: methyl 1-(2-methoxy-2-oxidanylidene-ethyl)-2-methyl-1-oxidanyl-3,4-dihydrophenanthrene-2-carboxylate
MOLECULAR FORMULA: C20H22O5
MOLECULAR WEIGHT: 342.38568
SMILES: CC1(CCC2=C(C1(CC(=O)OC)O)C=CC3=CC=CC=C23)C(=O)OC
Structure:
CAS RN: 7471-41-2
CAS Name: 1-(carboxymethyl)-5,9-dimethoxy-2-methyl-3,4-dihydro-1H-phenanthrene-2-carboxylic acid
OPENEYE Name: 1-(carboxymethyl)-5,9-dimethoxy-2-methyl-3,4-dihydro-1H-phenanthrene-2-carboxylic acid
IUPAC Name: 1-(carboxymethyl)-5,9-dimethoxy-2-methyl-3,4-dihydro-1H-phenanthrene-2-carboxylic acid
SYSTEMATIC NAME: 1-(2-hydroxy-2-oxoethyl)-5,9-dimethoxy-2-methyl-3,4-dihydro-1H-phenanthrene-2-carboxylic acid
MOLECULAR FORMULA: C20H22O6
MOLECULAR WEIGHT: 358.38508
SMILES: CC1(CCC2=C3C(=C(C=C2C1CC(=O)O)OC)C=CC=C3OC)C(=O)O
Structure:
CAS RN: 7471-39-8
CAS Name: 2-(2-methoxy-2-oxoethyl)-1-methyl-3,4-dihydro-2H-phenanthrene-1-carboxylic acid methyl ester
OPENEYE Name: methyl 2-(2-methoxy-2-oxo-ethyl)-1-methyl-3,4-dihydro-2H-phenanthrene-1-carboxylate
IUPAC Name: methyl 2-(2-methoxy-2-oxoethyl)-1-methyl-3,4-dihydro-2H-phenanthrene-1-carboxylate
SYSTEMATIC NAME: methyl 2-(2-methoxy-2-oxidanylidene-ethyl)-1-methyl-3,4-dihydro-2H-phenanthrene-1-carboxylate
MOLECULAR FORMULA: C20H22O4
MOLECULAR WEIGHT: 326.38628
SMILES: CC1(C(CCC2=C1C=CC3=CC=CC=C23)CC(=O)OC)C(=O)OC
Structure:
CAS RN: 7471-38-7
CAS Name: 6-methoxy-2-methyl-1-oxo-3,4-dihydrophenanthrene-2-carboxylic acid methyl ester
OPENEYE Name: methyl 6-methoxy-2-methyl-1-oxo-3,4-dihydrophenanthrene-2-carboxylate
IUPAC Name: methyl 6-methoxy-2-methyl-1-oxo-3,4-dihydrophenanthrene-2-carboxylate
SYSTEMATIC NAME: methyl 6-methoxy-2-methyl-1-oxidanylidene-3,4-dihydrophenanthrene-2-carboxylate
MOLECULAR FORMULA: C18H18O4
MOLECULAR WEIGHT: 298.33312
SMILES: CC1(CCC2=C(C1=O)C=CC3=C2C=C(C=C3)OC)C(=O)OC
Structure:
CAS RN: 7471-37-6
CAS Name: 2-(1,2,3,4,5,6,7,8-octahydrophenanthren-2-yl)-2-oxoacetic acid methyl ester
OPENEYE Name: methyl 2-(1,2,3,4,5,6,7,8-octahydrophenanthren-2-yl)-2-oxo-acetate
IUPAC Name: methyl 2-(1,2,3,4,5,6,7,8-octahydrophenanthren-2-yl)-2-oxoacetate
SYSTEMATIC NAME: methyl 2-(1,2,3,4,5,6,7,8-octahydrophenanthren-2-yl)-2-oxidanylidene-ethanoate
MOLECULAR FORMULA: C17H20O3
MOLECULAR WEIGHT: 272.3389
SMILES: COC(=O)C(=O)C1CCC2=C(C1)C=CC3=C2CCCC3
Structure:
CAS RN: 7471-36-5
CAS Name: 2-methyl-1-oxo-3,4-dihydrophenanthrene-2-carboxylic acid methyl ester
OPENEYE Name: methyl 2-methyl-1-oxo-3,4-dihydrophenanthrene-2-carboxylate
IUPAC Name: methyl 2-methyl-1-oxo-3,4-dihydrophenanthrene-2-carboxylate
SYSTEMATIC NAME: methyl 2-methyl-1-oxidanylidene-3,4-dihydrophenanthrene-2-carboxylate
MOLECULAR FORMULA: C17H16O3
MOLECULAR WEIGHT: 268.30714
SMILES: CC1(CCC2=C(C1=O)C=CC3=CC=CC=C23)C(=O)OC
Structure:
CAS RN: 7471-35-4
CAS Name: 7-methoxy-3a,10,11,11a-tetrahydronaphtho[2,1-e]isobenzofuran-1,3-dione
OPENEYE Name: 7-methoxy-3a,10,11,11a-tetrahydronaphtho[2,1-e]isobenzofuran-1,3-dione
IUPAC Name: 7-methoxy-3a,10,11,11a-tetrahydronaphtho[2,1-e][2]benzofuran-1,3-dione
SYSTEMATIC NAME: 7-methoxy-3a,10,11,11a-tetrahydronaphtho[2,1-e][2]benzofuran-1,3-dione
MOLECULAR FORMULA: C17H14O4
MOLECULAR WEIGHT: 282.29066
SMILES: COC1=CC2=C(C=C1)C3=C(C=C2)C4C(CC3)C(=O)OC4=O
Structure:
CAS RN: 7471-34-3
CAS Name: 2-[1,2-dihydroacenaphthylen-4-yl(oxo)methyl]benzoic acid
OPENEYE Name: 2-(1,2-dihydroacenaphthylene-4-carbonyl)benzoic acid
IUPAC Name: 2-(1,2-dihydroacenaphthylene-4-carbonyl)benzoic acid
SYSTEMATIC NAME: 2-(1,2-dihydroacenaphthylen-4-ylcarbonyl)benzoic acid
MOLECULAR FORMULA: C20H14O3
MOLECULAR WEIGHT: 302.32336
SMILES: C1CC2=C3C1=CC=CC3=CC(=C2)C(=O)C4=CC=CC=C4C(=O)O
Structure:
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