Friday, November 11, 2011

All Chemical Compounds Information




Product OPENEYE NAME: 1-methyl-4-(1,1,3-trimethylbutyl)cyclohexane
CAS Name: 1-(2,4-dimethylpentan-2-yl)-4-methylcyclohexane
IUPAC NAME: 1-(2,4-dimethylpentan-2-yl)-4-methylcyclohexane
SYSTEMATIC NAME: 1-(2,4-dimethylpentan-2-yl)-4-methyl-cyclohexane
MOLECULAR FORMULA: C14H28
MOLECULAR WEIGHT: 196.37212
SMILES: CC1CCC(CC1)C(C)(C)CC(C)C
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Product OPENEYE NAME: (E)-N-cyclohexyl-N-ethyl-3-fluoro-prop-2-enamide
CAS Name: (E)-N-cyclohexyl-N-ethyl-3-fluoro-2-propenamide
IUPAC NAME: (E)-N-cyclohexyl-N-ethyl-3-fluoroprop-2-enamide
SYSTEMATIC NAME: (E)-N-cyclohexyl-N-ethyl-3-fluoranyl-prop-2-enamide
MOLECULAR FORMULA: C11H18FNO
MOLECULAR WEIGHT: 199.265123
SMILES: CCN(C1CCCCC1)C(=O)/C=C/F
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Product OPENEYE NAME: 1-(1,1-dimethylpentyl)-4-methyl-cyclohexane
CAS Name: 1-methyl-4-(2-methylhexan-2-yl)cyclohexane
IUPAC NAME: 1-methyl-4-(2-methylhexan-2-yl)cyclohexane
SYSTEMATIC NAME: 1-methyl-4-(2-methylhexan-2-yl)cyclohexane
MOLECULAR FORMULA: C14H28
MOLECULAR WEIGHT: 196.37212
SMILES: CCCCC(C)(C)C1CCC(CC1)C
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Product OPENEYE NAME: 1-methyl-4-(1,1,2-trimethylbutyl)cyclohexane
CAS Name: 1-(2,3-dimethylpentan-2-yl)-4-methylcyclohexane
IUPAC NAME: 1-(2,3-dimethylpentan-2-yl)-4-methylcyclohexane
SYSTEMATIC NAME: 1-(2,3-dimethylpentan-2-yl)-4-methyl-cyclohexane
MOLECULAR FORMULA: C14H28
MOLECULAR WEIGHT: 196.37212
SMILES: CCC(C)C(C)(C)C1CCC(CC1)C
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Product OPENEYE NAME: methylsulfonyl(methylsulfonylmethoxy)methane
CAS Name: methylsulfonyl(methylsulfonylmethoxy)methane
IUPAC NAME: methylsulfonyl(methylsulfonylmethoxy)methane
SYSTEMATIC NAME: methylsulfonyl(methylsulfonylmethoxy)methane
MOLECULAR FORMULA: C4H10O5S2
MOLECULAR WEIGHT: 202.2492
SMILES: CS(=O)(=O)COCS(=O)(=O)C
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Product OPENEYE NAME: 7-[[1-(benzyloxymethyl)-2-isopropoxy-ethoxy]methyl]purine
CAS Name: 7-[(1-phenylmethoxy-3-propan-2-yloxypropan-2-yl)oxymethyl]purine
IUPAC NAME: 7-[(1-phenylmethoxy-3-propan-2-yloxypropan-2-yl)oxymethyl]purine
SYSTEMATIC NAME: 7-[(1-phenylmethoxy-3-propan-2-yloxy-propan-2-yl)oxymethyl]purine
MOLECULAR FORMULA: C19H24N4O3
MOLECULAR WEIGHT: 356.41886
SMILES: CC(C)OCC(COCC1=CC=CC=C1)OCN2C=NC3=NC=NC=C32
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Product OPENEYE NAME: (E)-1-isopropoxyhex-4-en-3-ol
CAS Name: (E)-1-propan-2-yloxy-4-hexen-3-ol
IUPAC NAME: (E)-1-propan-2-yloxyhex-4-en-3-ol
SYSTEMATIC NAME: (E)-1-propan-2-yloxyhex-4-en-3-ol
MOLECULAR FORMULA: C9H18O2
MOLECULAR WEIGHT: 158.23802
SMILES: C/C=C/C(CCOC(C)C)O
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Product OPENEYE NAME: [2-[[1-(benzyloxymethyl)-2-isopropoxy-ethoxy]methoxy]-3-isopropoxy-propoxy]methylbenzene
CAS Name: [2-[(1-phenylmethoxy-3-propan-2-yloxypropan-2-yl)oxymethoxy]-3-propan-2-yloxypropoxy]methylbenzene
IUPAC NAME: [2-[(1-phenylmethoxy-3-propan-2-yloxypropan-2-yl)oxymethoxy]-3-propan-2-yloxypropoxy]methylbenzene
SYSTEMATIC NAME: [2-[(1-phenylmethoxy-3-propan-2-yloxy-propan-2-yl)oxymethoxy]-3-propan-2-yloxy-propoxy]methylbenzene
MOLECULAR FORMULA: C27H40O6
MOLECULAR WEIGHT: 460.6029
SMILES: CC(C)OCC(COCC1=CC=CC=C1)OCOC(COCC2=CC=CC=C2)COC(C)C
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Product OPENEYE NAME: 2,8-dimethylnonan-4-ol
CAS Name: 2,8-dimethyl-4-nonanol
IUPAC NAME: 2,8-dimethylnonan-4-ol
SYSTEMATIC NAME: 2,8-dimethylnonan-4-ol
MOLECULAR FORMULA: C11H24O
MOLECULAR WEIGHT: 172.30766
SMILES: CC(C)CCCC(CC(C)C)O
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Product OPENEYE NAME: methyl 2-(4-amino-5-cyclohexyl-3-hydroxy-pentyl)sulfanylacetate
CAS Name: 2-[(4-amino-5-cyclohexyl-3-hydroxypentyl)thio]acetic acid methyl ester
IUPAC NAME: methyl 2-(4-amino-5-cyclohexyl-3-hydroxypentyl)sulfanylacetate
SYSTEMATIC NAME: methyl 2-(4-azanyl-5-cyclohexyl-3-oxidanyl-pentyl)sulfanylethanoate
MOLECULAR FORMULA: C14H27NO3S
MOLECULAR WEIGHT: 289.43408
SMILES: COC(=O)CSCCC(C(CC1CCCCC1)N)O
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Product OPENEYE NAME: tert-butyl 4-(cyclohexylmethyl)-5-[(2-methoxy-2-oxo-ethyl)sulfanylmethyl]-2,2-dimethyl-oxazolidine-3-carboxylate
CAS Name: 4-(cyclohexylmethyl)-5-[[(2-methoxy-2-oxoethyl)thio]methyl]-2,2-dimethyl-3-oxazolidinecarboxylic acid tert-butyl ester
IUPAC NAME: tert-butyl 4-(cyclohexylmethyl)-5-[(2-methoxy-2-oxoethyl)sulfanylmethyl]-2,2-dimethyl-1,3-oxazolidine-3-carboxylate
SYSTEMATIC NAME: tert-butyl 4-(cyclohexylmethyl)-5-[(2-methoxy-2-oxidanylidene-ethyl)sulfanylmethyl]-2,2-dimethyl-1,3-oxazolidine-3-carboxylate
MOLECULAR FORMULA: C21H37NO5S
MOLECULAR WEIGHT: 415.58718
SMILES: CC1(N(C(C(O1)CSCC(=O)OC)CC2CCCCC2)C(=O)OC(C)(C)C)C
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