Saturday, August 3, 2013

All Chemical Compounds Information




Product OPENEYE NAME: ethyl 4-(1-ethyl-2-oxo-cyclohexyl)butanoate
CAS Name: 4-(1-ethyl-2-oxocyclohexyl)butanoic acid ethyl ester
IUPAC NAME: ethyl 4-(1-ethyl-2-oxocyclohexyl)butanoate
SYSTEMATIC NAME: ethyl 4-(1-ethyl-2-oxidanylidene-cyclohexyl)butanoate
MOLECULAR FORMULA: C14H24O3
MOLECULAR WEIGHT: 240.33856
SMILES: CCC1(CCCCC1=O)CCCC(=O)OCC
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Product OPENEYE NAME: 8-(5-oxocyclopenten-1-yl)octanoic acid
CAS Name: 8-(5-oxo-1-cyclopentenyl)octanoic acid
IUPAC NAME: 8-(5-oxocyclopenten-1-yl)octanoic acid
SYSTEMATIC NAME: 8-(5-oxidanylidenecyclopenten-1-yl)octanoic acid
MOLECULAR FORMULA: C13H20O3
MOLECULAR WEIGHT: 224.2961
SMILES: C1CC(=O)C(=C1)CCCCCCCC(=O)O
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Product OPENEYE NAME: 2,2-diethyl-7-[2-[(E)-oct-1-enyl]cyclopentyl]heptanoate
CAS Name: 2,2-diethyl-7-[2-[(E)-oct-1-enyl]cyclopentyl]heptanoate
IUPAC NAME: 2,2-diethyl-7-[2-[(E)-oct-1-enyl]cyclopentyl]heptanoate
SYSTEMATIC NAME: 2,2-diethyl-7-[2-[(E)-oct-1-enyl]cyclopentyl]heptanoate
MOLECULAR FORMULA: C24H43O2-
MOLECULAR WEIGHT: 363.59702
SMILES: CCCCCC/C=C/C1CCCC1CCCCCC(CC)(CC)C(=O)[O-]
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Product OPENEYE NAME: 2,2-diethyl-7-[2-[(E)-oct-1-enyl]cyclopentyl]heptanoic acid
CAS Name: 2,2-diethyl-7-[2-[(E)-oct-1-enyl]cyclopentyl]heptanoic acid
IUPAC NAME: 2,2-diethyl-7-[2-[(E)-oct-1-enyl]cyclopentyl]heptanoic acid
SYSTEMATIC NAME: 2,2-diethyl-7-[2-[(E)-oct-1-enyl]cyclopentyl]heptanoic acid
MOLECULAR FORMULA: C24H44O2
MOLECULAR WEIGHT: 364.60496
SMILES: CCCCCC/C=C/C1CCCC1CCCCCC(CC)(CC)C(=O)O
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Product OPENEYE NAME: 2-(5-cyclopent-2-en-1-ylpentyl)propanedioic acid
CAS Name: 2-[5-(1-cyclopent-2-enyl)pentyl]propanedioic acid
IUPAC NAME: 2-(5-cyclopent-2-en-1-ylpentyl)propanedioic acid
SYSTEMATIC NAME: 2-(5-cyclopent-2-en-1-ylpentyl)propanedioic acid
MOLECULAR FORMULA: C13H20O4
MOLECULAR WEIGHT: 240.2955
SMILES: C1CC(C=C1)CCCCCC(C(=O)O)C(=O)O
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Product OPENEYE NAME: 2-ethyl-7-(2-oct-4-ynylcyclopentyl)heptanoate
CAS Name: 2-ethyl-7-(2-oct-4-ynylcyclopentyl)heptanoate
IUPAC NAME: 2-ethyl-7-(2-oct-4-ynylcyclopentyl)heptanoate
SYSTEMATIC NAME: 2-ethyl-7-(2-oct-4-ynylcyclopentyl)heptanoate
MOLECULAR FORMULA: C22H37O2-
MOLECULAR WEIGHT: 333.52798
SMILES: CCCC#CCCCC1CCCC1CCCCCC(CC)C(=O)[O-]
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Product OPENEYE NAME: 2-ethyl-7-(2-oct-4-ynylcyclopentyl)heptanoic acid
CAS Name: 2-ethyl-7-(2-oct-4-ynylcyclopentyl)heptanoic acid
IUPAC NAME: 2-ethyl-7-(2-oct-4-ynylcyclopentyl)heptanoic acid
SYSTEMATIC NAME: 2-ethyl-7-(2-oct-4-ynylcyclopentyl)heptanoic acid
MOLECULAR FORMULA: C22H38O2
MOLECULAR WEIGHT: 334.53592
SMILES: CCCC#CCCCC1CCCC1CCCCCC(CC)C(=O)O
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Product OPENEYE NAME: 7-[2-[(E)-oct-4-enyl]cyclopentyl]heptanoate
CAS Name: 7-[2-[(E)-oct-4-enyl]cyclopentyl]heptanoate
IUPAC NAME: 7-[2-[(E)-oct-4-enyl]cyclopentyl]heptanoate
SYSTEMATIC NAME: 7-[2-[(E)-oct-4-enyl]cyclopentyl]heptanoate
MOLECULAR FORMULA: C20H35O2-
MOLECULAR WEIGHT: 307.4907
SMILES: CCC/C=C/CCCC1CCCC1CCCCCCC(=O)[O-]
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Product OPENEYE NAME: 7-[2-[(E)-oct-4-enyl]cyclopentyl]heptanoic acid
CAS Name: 7-[2-[(E)-oct-4-enyl]cyclopentyl]heptanoic acid
IUPAC NAME: 7-[2-[(E)-oct-4-enyl]cyclopentyl]heptanoic acid
SYSTEMATIC NAME: 7-[2-[(E)-oct-4-enyl]cyclopentyl]heptanoic acid
MOLECULAR FORMULA: C20H36O2
MOLECULAR WEIGHT: 308.49864
SMILES: CCC/C=C/CCCC1CCCC1CCCCCCC(=O)O
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Product OPENEYE NAME: ethyl 7-[2-(3-hydroxyoct-4-ynyl)-5-oxo-cyclopentyl]heptanoate
CAS Name: 7-[2-(3-hydroxyoct-4-ynyl)-5-oxocyclopentyl]heptanoic acid ethyl ester
IUPAC NAME: ethyl 7-[2-(3-hydroxyoct-4-ynyl)-5-oxocyclopentyl]heptanoate
SYSTEMATIC NAME: ethyl 7-[2-oxidanylidene-5-(3-oxidanyloct-4-ynyl)cyclopentyl]heptanoate
MOLECULAR FORMULA: C22H36O4
MOLECULAR WEIGHT: 364.51884
SMILES: CCCC#CC(CCC1CCC(=O)C1CCCCCCC(=O)OCC)O
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Product OPENEYE NAME: ethyl 8-(2-acetoxycyclohexen-1-yl)octanoate
CAS Name: 8-(2-acetyloxy-1-cyclohexenyl)octanoic acid ethyl ester
IUPAC NAME: ethyl 8-(2-acetyloxycyclohexen-1-yl)octanoate
SYSTEMATIC NAME: ethyl 8-(2-acetyloxycyclohexen-1-yl)octanoate
MOLECULAR FORMULA: C18H30O4
MOLECULAR WEIGHT: 310.4284
SMILES: CCOC(=O)CCCCCCCC1=C(CCCC1)OC(=O)C
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Product OPENEYE NAME: [1-ethynyloctoxy(diphenyl)methyl]benzene
CAS Name: [dec-1-yn-3-yloxy(diphenyl)methyl]benzene
IUPAC NAME: [dec-1-yn-3-yloxy(diphenyl)methyl]benzene
SYSTEMATIC NAME: [dec-1-yn-3-yloxy(diphenyl)methyl]benzene
MOLECULAR FORMULA: C29H32O
MOLECULAR WEIGHT: 396.56378
SMILES: CCCCCCCC(C#C)OC(C1=CC=CC=C1)(C2=CC=CC=C2)C3=CC=CC=C3
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Product OPENEYE NAME: methyl (E)-2,3-dihydroxy-2-methyl-7-[2-[(1E,5E)-octa-1,5-dienyl]cyclopentyl]hept-5-enoate
CAS Name: (E)-2,3-dihydroxy-2-methyl-7-[2-[(1E,5E)-octa-1,5-dienyl]cyclopentyl]-5-heptenoic acid methyl ester
IUPAC NAME: methyl (E)-2,3-dihydroxy-2-methyl-7-[2-[(1E,5E)-octa-1,5-dienyl]cyclopentyl]hept-5-enoate
SYSTEMATIC NAME: methyl (E)-2-methyl-7-[2-[(1E,5E)-octa-1,5-dienyl]cyclopentyl]-2,3-bis(oxidanyl)hept-5-enoate
MOLECULAR FORMULA: C22H36O4
MOLECULAR WEIGHT: 364.51884
SMILES: CC/C=C/CC/C=C/C1CCCC1C/C=C/CC(C(C)(C(=O)OC)O)O
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Product OPENEYE NAME: 2-[4-(2-octylcyclopentyl)butylsulfanyl]acetate
CAS Name: 2-[4-(2-octylcyclopentyl)butylthio]acetate
IUPAC NAME: 2-[4-(2-octylcyclopentyl)butylsulfanyl]acetate
SYSTEMATIC NAME: 2-[4-(2-octylcyclopentyl)butylsulfanyl]ethanoate
MOLECULAR FORMULA: C19H35O2S-
MOLECULAR WEIGHT: 327.545
SMILES: CCCCCCCCC1CCCC1CCCCSCC(=O)[O-]
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