Saturday, August 3, 2013

All Chemical Compounds Information




Product OPENEYE NAME: 2-[4-(2-octylcyclopentyl)butoxy]acetic acid
CAS Name: 2-[4-(2-octylcyclopentyl)butoxy]acetic acid
IUPAC NAME: 2-[4-(2-octylcyclopentyl)butoxy]acetic acid
SYSTEMATIC NAME: 2-[4-(2-octylcyclopentyl)butoxy]ethanoic acid
MOLECULAR FORMULA: C19H36O3
MOLECULAR WEIGHT: 312.48734
SMILES: CCCCCCCCC1CCCC1CCCCOCC(=O)O
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Product OPENEYE NAME: 2-fluoro-7-[2-[(E)-oct-1-enyl]cyclopentyl]heptanoate
CAS Name: 2-fluoro-7-[2-[(E)-oct-1-enyl]cyclopentyl]heptanoate
IUPAC NAME: 2-fluoro-7-[2-[(E)-oct-1-enyl]cyclopentyl]heptanoate
SYSTEMATIC NAME: 2-fluoranyl-7-[2-[(E)-oct-1-enyl]cyclopentyl]heptanoate
MOLECULAR FORMULA: C20H34FO2-
MOLECULAR WEIGHT: 325.481163
SMILES: CCCCCC/C=C/C1CCCC1CCCCCC(C(=O)[O-])F
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Product OPENEYE NAME: 2-fluoro-7-[2-[(E)-oct-1-enyl]cyclopentyl]heptanoic acid
CAS Name: 2-fluoro-7-[2-[(E)-oct-1-enyl]cyclopentyl]heptanoic acid
IUPAC NAME: 2-fluoro-7-[2-[(E)-oct-1-enyl]cyclopentyl]heptanoic acid
SYSTEMATIC NAME: 2-fluoranyl-7-[2-[(E)-oct-1-enyl]cyclopentyl]heptanoic acid
MOLECULAR FORMULA: C20H35FO2
MOLECULAR WEIGHT: 326.489103
SMILES: CCCCCC/C=C/C1CCCC1CCCCCC(C(=O)O)F
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Product OPENEYE NAME: [(E)-5,5-dimethyl-3-trityloxy-oct-1-enyl]-trimethyl-alumanuide
CAS Name: [(E)-5,5-dimethyl-3-(triphenylmethyl)oxyoct-1-enyl]-trimethylalumanuide
IUPAC NAME: [(E)-5,5-dimethyl-3-trityloxyoct-1-enyl]-trimethylalumanuide
SYSTEMATIC NAME: [(E)-5,5-dimethyl-3-(triphenylmethyl)oxy-oct-1-enyl]-trimethyl-alumanuide
MOLECULAR FORMULA: C32H42AlO-
MOLECULAR WEIGHT: 469.656818
SMILES: CCCC(C)(C)CC(/C=C/[Al-](C)(C)C)OC(C1=CC=CC=C1)(C2=CC=CC=C2)C3=CC=CC=C3
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Product OPENEYE NAME: (E)-7-[2-(3-hydroxyoctyl)-5-oxo-cyclopentyl]-2-methyl-hept-2-enoic acid
CAS Name: (E)-7-[2-(3-hydroxyoctyl)-5-oxocyclopentyl]-2-methyl-2-heptenoic acid
IUPAC NAME: (E)-7-[2-(3-hydroxyoctyl)-5-oxocyclopentyl]-2-methylhept-2-enoic acid
SYSTEMATIC NAME: (E)-2-methyl-7-[2-oxidanylidene-5-(3-oxidanyloctyl)cyclopentyl]hept-2-enoic acid
MOLECULAR FORMULA: C21H36O4
MOLECULAR WEIGHT: 352.50814
SMILES: CCCCCC(CCC1CCC(=O)C1CCCC/C=C(\C)/C(=O)O)O
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Product OPENEYE NAME: [[(E)-1-[(E)-2-iodovinyl]hex-3-enoxy]-diphenyl-methyl]benzene
CAS Name: [[(1E,5E)-1-iodoocta-1,5-dien-3-yl]oxy-diphenylmethyl]benzene
IUPAC NAME: [[(1E,5E)-1-iodoocta-1,5-dien-3-yl]oxy-diphenylmethyl]benzene
SYSTEMATIC NAME: [[(1E,5E)-1-iodanylocta-1,5-dien-3-yl]oxy-diphenyl-methyl]benzene
MOLECULAR FORMULA: C27H27IO
MOLECULAR WEIGHT: 494.40715
SMILES: CC/C=C/CC(/C=C/I)OC(C1=CC=CC=C1)(C2=CC=CC=C2)C3=CC=CC=C3
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Product OPENEYE NAME: [[(E)-1-[(E)-2-bromovinyl]hex-3-enoxy]-diphenyl-methyl]benzene
CAS Name: [[(1E,5E)-1-bromoocta-1,5-dien-3-yl]oxy-diphenylmethyl]benzene
IUPAC NAME: [[(1E,5E)-1-bromoocta-1,5-dien-3-yl]oxy-diphenylmethyl]benzene
SYSTEMATIC NAME: [[(1E,5E)-1-bromanylocta-1,5-dien-3-yl]oxy-diphenyl-methyl]benzene
MOLECULAR FORMULA: C27H27BrO
MOLECULAR WEIGHT: 447.40668
SMILES: CC/C=C/CC(/C=C/Br)OC(C1=CC=CC=C1)(C2=CC=CC=C2)C3=CC=CC=C3
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Product OPENEYE NAME: lithium [(E)-3-methoxyoct-1-enyl]-trimethyl-alumanuide
CAS Name: lithium [(E)-3-methoxyoct-1-enyl]-trimethylalumanuide
IUPAC NAME: lithium [(E)-3-methoxyoct-1-enyl]-trimethylalumanuide
SYSTEMATIC NAME: lithium [(E)-3-methoxyoct-1-enyl]-trimethyl-alumanuide
MOLECULAR FORMULA: C12H26AlLiO
MOLECULAR WEIGHT: 220.256778
SMILES: [Li+].CCCCCC(/C=C/[Al-](C)(C)C)OC
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Product OPENEYE NAME: [(E)-3-methoxyoct-1-enyl]-trimethyl-alumanuide
CAS Name: [(E)-3-methoxyoct-1-enyl]-trimethylalumanuide
IUPAC NAME: [(E)-3-methoxyoct-1-enyl]-trimethylalumanuide
SYSTEMATIC NAME: [(E)-3-methoxyoct-1-enyl]-trimethyl-alumanuide
MOLECULAR FORMULA: C12H26AlO-
MOLECULAR WEIGHT: 213.315778
SMILES: CCCCCC(/C=C/[Al-](C)(C)C)OC
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Product OPENEYE NAME: 2-propylhex-5-ynenitrile
CAS Name: 2-propyl-5-hexynenitrile
IUPAC NAME: 2-propylhex-5-ynenitrile
SYSTEMATIC NAME: 2-propylhex-5-ynenitrile
MOLECULAR FORMULA: C9H13N
MOLECULAR WEIGHT: 135.20622
SMILES: CCCC(CCC#C)C#N
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Product OPENEYE NAME: ethyl 6-(2-acetoxycyclohexen-1-yl)hexanoate
CAS Name: 6-(2-acetyloxy-1-cyclohexenyl)hexanoic acid ethyl ester
IUPAC NAME: ethyl 6-(2-acetyloxycyclohexen-1-yl)hexanoate
SYSTEMATIC NAME: ethyl 6-(2-acetyloxycyclohexen-1-yl)hexanoate
MOLECULAR FORMULA: C16H26O4
MOLECULAR WEIGHT: 282.37524
SMILES: CCOC(=O)CCCCCC1=C(CCCC1)OC(=O)C
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Product OPENEYE NAME: (E)-7-[2-[(1E,5E)-octa-1,5-dienyl]cyclopentyl]hept-5-enoate
CAS Name: (E)-7-[2-[(1E,5E)-octa-1,5-dienyl]cyclopentyl]-5-heptenoate
IUPAC NAME: (E)-7-[2-[(1E,5E)-octa-1,5-dienyl]cyclopentyl]hept-5-enoate
SYSTEMATIC NAME: (E)-7-[2-[(1E,5E)-octa-1,5-dienyl]cyclopentyl]hept-5-enoate
MOLECULAR FORMULA: C20H31O2-
MOLECULAR WEIGHT: 303.45894
SMILES: CC/C=C/CC/C=C/C1CCCC1C/C=C/CCCC(=O)[O-]
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Product OPENEYE NAME: (E)-7-[2-[(1E,5E)-octa-1,5-dienyl]cyclopentyl]hept-5-enoic acid
CAS Name: (E)-7-[2-[(1E,5E)-octa-1,5-dienyl]cyclopentyl]-5-heptenoic acid
IUPAC NAME: (E)-7-[2-[(1E,5E)-octa-1,5-dienyl]cyclopentyl]hept-5-enoic acid
SYSTEMATIC NAME: (E)-7-[2-[(1E,5E)-octa-1,5-dienyl]cyclopentyl]hept-5-enoic acid
MOLECULAR FORMULA: C20H32O2
MOLECULAR WEIGHT: 304.46688
SMILES: CC/C=C/CC/C=C/C1CCCC1C/C=C/CCCC(=O)O
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Product OPENEYE NAME: tripropyl-[(E)-3-trityloxyoct-1-enyl]alumanuide
CAS Name: tripropyl-[(E)-3-(triphenylmethyl)oxyoct-1-enyl]alumanuide
IUPAC NAME: tripropyl-[(E)-3-trityloxyoct-1-enyl]alumanuide
SYSTEMATIC NAME: tripropyl-[(E)-3-(triphenylmethyl)oxyoct-1-enyl]alumanuide
MOLECULAR FORMULA: C36H50AlO-
MOLECULAR WEIGHT: 525.763138
SMILES: CCCCCC(/C=C/[Al-](CCC)(CCC)CCC)OC(C1=CC=CC=C1)(C2=CC=CC=C2)C3=CC=CC=C3
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Product OPENEYE NAME: 2-(5-oxocyclopenten-1-yl)acetaldehyde
CAS Name: 2-(5-oxo-1-cyclopentenyl)acetaldehyde
IUPAC NAME: 2-(5-oxocyclopenten-1-yl)acetaldehyde
SYSTEMATIC NAME: 2-(5-oxidanylidenecyclopenten-1-yl)ethanal
MOLECULAR FORMULA: C7H8O2
MOLECULAR WEIGHT: 124.13722
SMILES: C1CC(=O)C(=C1)CC=O
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Product OPENEYE NAME: 4-[(5E)-5-methoxyiminocyclopenten-1-yl]butan-1-ol
CAS Name: 4-[(5E)-5-methoxyimino-1-cyclopentenyl]-1-butanol
IUPAC NAME: 4-[(5E)-5-methoxyiminocyclopenten-1-yl]butan-1-ol
SYSTEMATIC NAME: 4-[(5E)-5-methoxyiminocyclopenten-1-yl]butan-1-ol
MOLECULAR FORMULA: C10H17NO2
MOLECULAR WEIGHT: 183.24748
SMILES: CO/N=C/1\CCC=C1CCCCO
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Product OPENEYE NAME: 2-ethoxycarbonyl-3-methyl-but-2-enoate
CAS Name: 2-ethoxycarbonyl-3-methyl-2-butenoate
IUPAC NAME: 2-ethoxycarbonyl-3-methylbut-2-enoate
SYSTEMATIC NAME: 2-ethoxycarbonyl-3-methyl-but-2-enoate
MOLECULAR FORMULA: C8H11O4-
MOLECULAR WEIGHT: 171.17054
SMILES: CCOC(=O)C(=C(C)C)C(=O)[O-]
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Product OPENEYE NAME: 2-hydroxy-7-(2-octylcyclopentyl)heptanoic acid
CAS Name: 2-hydroxy-7-(2-octylcyclopentyl)heptanoic acid
IUPAC NAME: 2-hydroxy-7-(2-octylcyclopentyl)heptanoic acid
SYSTEMATIC NAME: 7-(2-octylcyclopentyl)-2-oxidanyl-heptanoic acid
MOLECULAR FORMULA: C20H38O3
MOLECULAR WEIGHT: 326.51392
SMILES: CCCCCCCCC1CCCC1CCCCCC(C(=O)O)O
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Product OPENEYE NAME: 2-[4-[(5E)-5-methoxyiminocyclopenten-1-yl]butoxy]acetic acid
CAS Name: 2-[4-[(5E)-5-methoxyimino-1-cyclopentenyl]butoxy]acetic acid
IUPAC NAME: 2-[4-[(5E)-5-methoxyiminocyclopenten-1-yl]butoxy]acetic acid
SYSTEMATIC NAME: 2-[4-[(5E)-5-methoxyiminocyclopenten-1-yl]butoxy]ethanoic acid
MOLECULAR FORMULA: C12H19NO4
MOLECULAR WEIGHT: 241.28356
SMILES: CO/N=C/1\CCC=C1CCCCOCC(=O)O
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Product OPENEYE NAME: (E)-7-(5-oxocyclopent-2-en-1-yl)hept-5-enoic acid
CAS Name: (E)-7-(5-oxo-1-cyclopent-2-enyl)-5-heptenoic acid
IUPAC NAME: (E)-7-(5-oxocyclopent-2-en-1-yl)hept-5-enoic acid
SYSTEMATIC NAME: (E)-7-(5-oxidanylidenecyclopent-2-en-1-yl)hept-5-enoic acid
MOLECULAR FORMULA: C12H16O3
MOLECULAR WEIGHT: 208.25364
SMILES: C1C=CC(C1=O)C/C=C/CCCC(=O)O
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Product OPENEYE NAME: ethyl 7-[2-[(E)-4,4-dimethyloct-1-enyl]cyclopentyl]heptanoate
CAS Name: 7-[2-[(E)-4,4-dimethyloct-1-enyl]cyclopentyl]heptanoic acid ethyl ester
IUPAC NAME: ethyl 7-[2-[(E)-4,4-dimethyloct-1-enyl]cyclopentyl]heptanoate
SYSTEMATIC NAME: ethyl 7-[2-[(E)-4,4-dimethyloct-1-enyl]cyclopentyl]heptanoate
MOLECULAR FORMULA: C24H44O2
MOLECULAR WEIGHT: 364.60496
SMILES: CCCCC(C)(C)C/C=C/C1CCCC1CCCCCCC(=O)OCC
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Product OPENEYE NAME: 7-[2-[(E)-3-hydroxyoct-1-enyl]-5-oxo-cyclopentyl]-2-methyl-heptanoic acid
CAS Name: 7-[2-[(E)-3-hydroxyoct-1-enyl]-5-oxocyclopentyl]-2-methylheptanoic acid
IUPAC NAME: 7-[2-[(E)-3-hydroxyoct-1-enyl]-5-oxocyclopentyl]-2-methylheptanoic acid
SYSTEMATIC NAME: 2-methyl-7-[2-oxidanylidene-5-[(E)-3-oxidanyloct-1-enyl]cyclopentyl]heptanoic acid
MOLECULAR FORMULA: C21H36O4
MOLECULAR WEIGHT: 352.50814
SMILES: CCCCCC(/C=C/C1CCC(=O)C1CCCCCC(C)C(=O)O)O
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