Wednesday, August 10, 2011

All Chemical Compounds Information




Product OPENEYE NAME: (1-methyl-1-phenyl-ethyl)benzene
CAS Name: 2-phenylpropan-2-ylbenzene
IUPAC NAME: 2-phenylpropan-2-ylbenzene
SYSTEMATIC NAME: 2-phenylpropan-2-ylbenzene
MOLECULAR FORMULA: C15H16
MOLECULAR WEIGHT: 196.28754
SMILES: CC(C)(C1=CC=CC=C1)C2=CC=CC=C2
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Product OPENEYE NAME: butyl 4-methylbenzenesulfonate
CAS Name: 4-methylbenzenesulfonic acid butyl ester
IUPAC NAME: butyl 4-methylbenzenesulfonate
SYSTEMATIC NAME: butyl 4-methylbenzenesulfonate
MOLECULAR FORMULA: C11H16O3S
MOLECULAR WEIGHT: 228.30794
SMILES: CCCCOS(=O)(=O)C1=CC=C(C=C1)C
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Product OPENEYE NAME: ethyl 2-(1H-indol-3-yl)acetate
CAS Name: 2-(1H-indol-3-yl)acetic acid ethyl ester
IUPAC NAME: ethyl 2-(1H-indol-3-yl)acetate
SYSTEMATIC NAME: ethyl 2-(1H-indol-3-yl)ethanoate
MOLECULAR FORMULA: C12H13NO2
MOLECULAR WEIGHT: 203.23712
SMILES: CCOC(=O)CC1=CNC2=CC=CC=C21
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Product OPENEYE NAME: 9-methylanthracene
CAS Name: 9-methylanthracene
IUPAC NAME: 9-methylanthracene
SYSTEMATIC NAME: 9-methylanthracene
MOLECULAR FORMULA: C15H12
MOLECULAR WEIGHT: 192.25578
SMILES: CC1=C2C=CC=CC2=CC3=CC=CC=C13
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Product OPENEYE NAME: anthracen-9-amine
CAS Name: 9-anthracenamine
IUPAC NAME: anthracen-9-amine
SYSTEMATIC NAME: anthracen-9-amine
MOLECULAR FORMULA: C14H11N
MOLECULAR WEIGHT: 193.24384
SMILES: C1=CC=C2C(=C1)C=C3C=CC=CC3=C2N
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Product OPENEYE NAME: (1-methyl-2-phenyl-vinyl)benzene
CAS Name: 1-phenylprop-1-en-2-ylbenzene
IUPAC NAME: 1-phenylprop-1-en-2-ylbenzene
SYSTEMATIC NAME: 1-phenylprop-1-en-2-ylbenzene
MOLECULAR FORMULA: C15H14
MOLECULAR WEIGHT: 194.27166
SMILES: CC(=CC1=CC=CC=C1)C2=CC=CC=C2
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Product OPENEYE NAME: N-cyclohexyl-4-methoxy-aniline
CAS Name: N-cyclohexyl-4-methoxyaniline
IUPAC NAME: N-cyclohexyl-4-methoxyaniline
SYSTEMATIC NAME: N-cyclohexyl-4-methoxy-aniline
MOLECULAR FORMULA: C13H19NO
MOLECULAR WEIGHT: 205.29606
SMILES: COC1=CC=C(C=C1)NC2CCCCC2
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Product OPENEYE NAME: (3-tert-butylphenyl) N-methylcarbamate
CAS Name: N-methylcarbamic acid (3-tert-butylphenyl) ester
IUPAC NAME: (3-tert-butylphenyl) N-methylcarbamate
SYSTEMATIC NAME: (3-tert-butylphenyl) N-methylcarbamate
MOLECULAR FORMULA: C12H17NO2
MOLECULAR WEIGHT: 207.26888
SMILES: CC(C)(C)C1=CC(=CC=C1)OC(=O)NC
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Product OPENEYE NAME: dibenzylmercury
CAS Name: bis(phenylmethyl)mercury
IUPAC NAME: dibenzylmercury
SYSTEMATIC NAME: bis(phenylmethyl)mercury
MOLECULAR FORMULA: C14H14Hg
MOLECULAR WEIGHT: 382.85096
SMILES: C1=CC=C(C=C1)C[Hg]CC2=CC=CC=C2
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Product OPENEYE NAME: 5,5-diallyl-1-methyl-hexahydropyrimidine-2,4,6-trione
CAS Name: 1-methyl-5,5-bis(prop-2-enyl)-1,3-diazinane-2,4,6-trione
IUPAC NAME: 1-methyl-5,5-bis(prop-2-enyl)-1,3-diazinane-2,4,6-trione
SYSTEMATIC NAME: 1-methyl-5,5-bis(prop-2-enyl)-1,3-diazinane-2,4,6-trione
MOLECULAR FORMULA: C11H14N2O3
MOLECULAR WEIGHT: 222.24046
SMILES: CN1C(=O)C(C(=O)NC1=O)(CC=C)CC=C
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