Wednesday, August 3, 2011

All Chemical Compounds Information




Product OPENEYE NAME:
CAS Name:
IUPAC NAME:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C15H24
MOLECULAR WEIGHT: 204.35106
SMILES: C[C@@H]1CC[C@@H]2C13CC=C(C(C3)C2(C)C)C
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Product OPENEYE NAME: [(1S,2R)-1-benzyl-3-(dimethylamino)-2-methyl-1-phenyl-propyl] propanoate
CAS Name: propanoic acid [(2S,3R)-4-(dimethylamino)-3-methyl-1,2-diphenylbutan-2-yl] ester
IUPAC NAME: [(2S,3R)-4-(dimethylamino)-3-methyl-1,2-diphenylbutan-2-yl] propanoate
SYSTEMATIC NAME: [(2S,3R)-4-(dimethylamino)-3-methyl-1,2-diphenyl-butan-2-yl] propanoate
MOLECULAR FORMULA: C22H29NO2
MOLECULAR WEIGHT: 339.47116
SMILES: CCC(=O)O[C@](CC1=CC=CC=C1)(C2=CC=CC=C2)[C@H](C)CN(C)C
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Product OPENEYE NAME: 1-[4-(3-hydroxyphenyl)-1-methyl-4-piperidyl]propan-1-one
CAS Name: 1-[4-(3-hydroxyphenyl)-1-methyl-4-piperidinyl]-1-propanone
IUPAC NAME: 1-[4-(3-hydroxyphenyl)-1-methylpiperidin-4-yl]propan-1-one
SYSTEMATIC NAME: 1-[4-(3-hydroxyphenyl)-1-methyl-piperidin-4-yl]propan-1-one
MOLECULAR FORMULA: C15H21NO2
MOLECULAR WEIGHT: 247.33274
SMILES: CCC(=O)C1(CCN(CC1)C)C2=CC(=CC=C2)O
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Product OPENEYE NAME:
CAS Name:
IUPAC NAME:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C15H24
MOLECULAR WEIGHT: 204.35106
SMILES: C[C@@]12CCC[C@]3(C1)C=CC([C@@H]3CC2)(C)C
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Product OPENEYE NAME:
CAS Name:
IUPAC NAME:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C26H34O6
MOLECULAR WEIGHT: 442.54456
SMILES: CC(=O)O[C@@H]1[C@@H](C2(CCC3C([C@@]24[C@@H]1O4)CC[C@H]5C3(CC[C@@H](C5)O)C)C)C6=CC(=O)OC=C6
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Product OPENEYE NAME:
CAS Name:
IUPAC NAME:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C24H32O5
MOLECULAR WEIGHT: 400.50788
SMILES: C[C@]12CCC3C([C@@]14[C@H](O4)C[C@@H]2C5=COC(=O)C=C5)CC[C@]6([C@@]3(CC[C@@H](C6)O)C)O
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Product OPENEYE NAME: (2,2-diisopropyl-1,3-dioxolan-4-yl)methanol
CAS Name: [2,2-di(propan-2-yl)-1,3-dioxolan-4-yl]methanol
IUPAC NAME: [2,2-di(propan-2-yl)-1,3-dioxolan-4-yl]methanol
SYSTEMATIC NAME: [2,2-di(propan-2-yl)-1,3-dioxolan-4-yl]methanol
MOLECULAR FORMULA: C10H20O3
MOLECULAR WEIGHT: 188.264
SMILES: CC(C)C1(OCC(O1)CO)C(C)C
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Product OPENEYE NAME: 4-isopropyl-1-methyl-7-oxabicyclo[2.2.1]heptane
CAS Name: 1-methyl-4-propan-2-yl-7-oxabicyclo[2.2.1]heptane
IUPAC NAME: 1-methyl-4-propan-2-yl-7-oxabicyclo[2.2.1]heptane
SYSTEMATIC NAME: 1-methyl-4-propan-2-yl-7-oxabicyclo[2.2.1]heptane
MOLECULAR FORMULA: C10H18O
MOLECULAR WEIGHT: 154.24932
SMILES: CC(C)C12CCC(O1)(CC2)C
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Product OPENEYE NAME: [2-chloro-1-(2,4-dichlorophenyl)vinyl] diethyl phosphate
CAS Name: phosphoric acid [2-chloro-1-(2,4-dichlorophenyl)ethenyl] diethyl ester
IUPAC NAME: [2-chloro-1-(2,4-dichlorophenyl)ethenyl] diethyl phosphate
SYSTEMATIC NAME: [2-chloranyl-1-(2,4-dichlorophenyl)ethenyl] diethyl phosphate
MOLECULAR FORMULA: C12H14Cl3O4P
MOLECULAR WEIGHT: 359.569921
SMILES: CCOP(=O)(OCC)OC(=CCl)C1=C(C=C(C=C1)Cl)Cl
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