Sunday, July 29, 2012

http://ChemLookup.com Compounds




CAS RN: 58241-12-6
CAS Name: 2,2-diphenylacetic acid phenyl ester
OPENEYE Name: phenyl 2,2-diphenylacetate
IUPAC Name: phenyl 2,2-diphenylacetate
SYSTEMATIC NAME: phenyl 2,2-diphenylethanoate
MOLECULAR FORMULA: C20H16O2
MOLECULAR WEIGHT: 288.33984
SMILES: C1=CC=C(C=C1)C(C2=CC=CC=C2)C(=O)OC3=CC=CC=C3
Structure:

CAS RN: 5563-20-2
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C21H31BrO3
MOLECULAR WEIGHT: 411.37304
SMILES: CC(=O)C1CCC2C1(CCC3C2CC4C5(C3(CCC(C5)O)CO4)Br)C
Structure:

CAS RN: 2686-05-7
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C20H26O2
MOLECULAR WEIGHT: 298.41924
SMILES: CC12CCC3C(C1CCC2=O)CCC4=CC(=CC=C3C4)OC
Structure:

CAS RN: 16301-30-7
CAS Name: 1-(2-chlorocyclohexyl)-3-methylurea
OPENEYE Name: 1-(2-chlorocyclohexyl)-3-methyl-urea
IUPAC Name: 1-(2-chlorocyclohexyl)-3-methylurea
SYSTEMATIC NAME: 1-(2-chloranylcyclohexyl)-3-methyl-urea
MOLECULAR FORMULA: C8H15ClN2O
MOLECULAR WEIGHT: 190.6705
SMILES: CNC(=O)NC1CCCCC1Cl
Structure:

CAS RN: 25731-54-8
CAS Name: 4-methoxy-N-(4-methoxyphenyl)azoaniline
OPENEYE Name: 4-methoxy-N-(4-methoxyphenyl)azo-aniline
IUPAC Name: 4-methoxy-N-[(4-methoxyphenyl)diazenyl]aniline
SYSTEMATIC NAME: 4-methoxy-N-[(4-methoxyphenyl)diazenyl]aniline
MOLECULAR FORMULA: C14H15N3O2
MOLECULAR WEIGHT: 257.2878
SMILES: COC1=CC=C(C=C1)NN=NC2=CC=C(C=C2)OC
Structure:

CAS RN: 2943-42-2
CAS Name: 1-methyl-4-[(4-methylphenyl)sulfonylthio]benzene
OPENEYE Name: 1-methyl-4-(p-tolylsulfonylsulfanyl)benzene
IUPAC Name: 1-methyl-4-(4-methylphenyl)sulfonylsulfanylbenzene
SYSTEMATIC NAME: 1-methyl-4-(4-methylphenyl)sulfonylsulfanyl-benzene
MOLECULAR FORMULA: C14H14O2S2
MOLECULAR WEIGHT: 278.38976
SMILES: CC1=CC=C(C=C1)SS(=O)(=O)C2=CC=C(C=C2)C
Structure:

CAS RN: 76478-22-3
CAS Name: 1-chloro-4-[(4-chlorophenyl)sulfonyldisulfanyl]sulfonylbenzene
OPENEYE Name: 1-chloro-4-[(4-chlorophenyl)sulfonyldisulfanyl]sulfonyl-benzene
IUPAC Name: 1-chloro-4-[(4-chlorophenyl)sulfonyldisulfanyl]sulfonylbenzene
SYSTEMATIC NAME: 1-chloranyl-4-[(4-chlorophenyl)sulfonyldisulfanyl]sulfonyl-benzene
MOLECULAR FORMULA: C12H8Cl2O4S4
MOLECULAR WEIGHT: 415.35552
SMILES: C1=CC(=CC=C1S(=O)(=O)SSS(=O)(=O)C2=CC=C(C=C2)Cl)Cl
Structure:

CAS RN: 57-16-9
CAS Name: acetic acid (17-acetyl-3-hydroxy-6,10,13-trimethyl-1,2,3,6,7,8,9,11,12,14,15,16-dodecahydrocyclopenta[a]phenanthren-17-yl) ester
OPENEYE Name: (17-acetyl-3-hydroxy-6,10,13-trimethyl-1,2,3,6,7,8,9,11,12,14,15,16-dodecahydrocyclopenta[a]phenanthren-17-yl) acetate
IUPAC Name: (17-acetyl-3-hydroxy-6,10,13-trimethyl-1,2,3,6,7,8,9,11,12,14,15,16-dodecahydrocyclopenta[a]phenanthren-17-yl) acetate
SYSTEMATIC NAME: (17-ethanoyl-6,10,13-trimethyl-3-oxidanyl-1,2,3,6,7,8,9,11,12,14,15,16-dodecahydrocyclopenta[a]phenanthren-17-yl) ethanoate
MOLECULAR FORMULA: C24H36O4
MOLECULAR WEIGHT: 388.54024
SMILES: CC1CC2C(CCC3(C2CCC3(C(=O)C)OC(=O)C)C)C4(C1=CC(CC4)O)C
Structure:

CAS RN: 855-05-0
CAS Name: 17-acetyl-15-hydroxy-10,13-dimethyl-2,6,7,8,9,12,14,15,16,17-decahydro-1H-cyclopenta[a]phenanthrene-3,11-dione
OPENEYE Name: 17-acetyl-15-hydroxy-10,13-dimethyl-2,6,7,8,9,12,14,15,16,17-decahydro-1H-cyclopenta[a]phenanthrene-3,11-dione
IUPAC Name: 17-acetyl-15-hydroxy-10,13-dimethyl-2,6,7,8,9,12,14,15,16,17-decahydro-1H-cyclopenta[a]phenanthrene-3,11-dione
SYSTEMATIC NAME: 17-ethanoyl-10,13-dimethyl-15-oxidanyl-2,6,7,8,9,12,14,15,16,17-decahydro-1H-cyclopenta[a]phenanthrene-3,11-dione
MOLECULAR FORMULA: C21H28O4
MOLECULAR WEIGHT: 344.44462
SMILES: CC(=O)C1CC(C2C1(CC(=O)C3C2CCC4=CC(=O)CCC34C)C)O
Structure:

CAS RN: 86960-45-4
CAS Name: 17-acetyl-15-hydroxy-10,13-dimethyl-2,6,7,8,9,12,14,15,16,17-decahydro-1H-cyclopenta[a]phenanthrene-3,11-dione
OPENEYE Name: 17-acetyl-15-hydroxy-10,13-dimethyl-2,6,7,8,9,12,14,15,16,17-decahydro-1H-cyclopenta[a]phenanthrene-3,11-dione
IUPAC Name: 17-acetyl-15-hydroxy-10,13-dimethyl-2,6,7,8,9,12,14,15,16,17-decahydro-1H-cyclopenta[a]phenanthrene-3,11-dione
SYSTEMATIC NAME: 17-ethanoyl-10,13-dimethyl-15-oxidanyl-2,6,7,8,9,12,14,15,16,17-decahydro-1H-cyclopenta[a]phenanthrene-3,11-dione
MOLECULAR FORMULA: C21H28O4
MOLECULAR WEIGHT: 344.44462
SMILES: CC(=O)C1CC(C2C1(CC(=O)C3C2CCC4=CC(=O)CCC34C)C)O
Structure:

CAS RN: 303-01-5
CAS Name: (5R,8R,9S,10S,13S,14S,17S)-17-(2-hydroxy-1-oxoethyl)-10,13-dimethyl-1,2,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthren-3-one
OPENEYE Name: (5R,8R,9S,10S,13S,14S,17S)-17-(2-hydroxyacetyl)-10,13-dimethyl-1,2,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthren-3-one
IUPAC Name: (5R,8R,9S,10S,13S,14S,17S)-17-(2-hydroxyacetyl)-10,13-dimethyl-1,2,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthren-3-one
SYSTEMATIC NAME: (5R,8R,9S,10S,13S,14S,17S)-10,13-dimethyl-17-(2-oxidanylethanoyl)-1,2,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthren-3-one
MOLECULAR FORMULA: C21H32O3
MOLECULAR WEIGHT: 332.47698
SMILES: C[C@]12CCC(=O)C[C@H]1CC[C@@H]3[C@@H]2CC[C@]4([C@H]3CC[C@@H]4C(=O)CO)C
Structure:

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