Tuesday, August 30, 2011

All Chemical Compounds Information




Product OPENEYE NAME: oct-7-en-2-one
CAS Name: 7-octen-2-one
IUPAC NAME: oct-7-en-2-one
SYSTEMATIC NAME: oct-7-en-2-one
MOLECULAR FORMULA: C8H14O
MOLECULAR WEIGHT: 126.19616
SMILES: CC(=O)CCCCC=C
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Product OPENEYE NAME: 4,8-dimethylnon-7-en-2-one
CAS Name: 4,8-dimethyl-7-nonen-2-one
IUPAC NAME: 4,8-dimethylnon-7-en-2-one
SYSTEMATIC NAME: 4,8-dimethylnon-7-en-2-one
MOLECULAR FORMULA: C11H20O
MOLECULAR WEIGHT: 168.2759
SMILES: CC(CCC=C(C)C)CC(=O)C
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Product OPENEYE NAME: 3-hydroxynaphthalene-2-carboxamide
CAS Name: 3-hydroxy-2-naphthalenecarboxamide
IUPAC NAME: 3-hydroxynaphthalene-2-carboxamide
SYSTEMATIC NAME: 3-oxidanylnaphthalene-2-carboxamide
MOLECULAR FORMULA: C11H9NO2
MOLECULAR WEIGHT: 187.19466
SMILES: C1=CC=C2C=C(C(=CC2=C1)C(=O)N)O
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Product OPENEYE NAME: N-ethyl-4-nitro-aniline
CAS Name: N-ethyl-4-nitroaniline
IUPAC NAME: N-ethyl-4-nitroaniline
SYSTEMATIC NAME: N-ethyl-4-nitro-aniline
MOLECULAR FORMULA: C8H10N2O2
MOLECULAR WEIGHT: 166.1772
SMILES: CCNC1=CC=C(C=C1)[N+](=O)[O-]
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Product OPENEYE NAME: 2-(8-methyl-8-phenyl-1,4-dioxaspiro[4.5]decan-3-yl)piperidin-1-ium chloride
CAS Name: 2-(8-methyl-8-phenyl-1,4-dioxaspiro[4.5]decan-3-yl)piperidin-1-ium chloride
IUPAC NAME: 2-(8-methyl-8-phenyl-1,4-dioxaspiro[4.5]decan-3-yl)piperidin-1-ium chloride
SYSTEMATIC NAME: 2-(8-methyl-8-phenyl-1,4-dioxaspiro[4.5]decan-3-yl)piperidin-1-ium chloride
MOLECULAR FORMULA: C20H30ClNO2
MOLECULAR WEIGHT: 351.9107
SMILES: CC1(CCC2(CC1)OCC(O2)C3CCCC[NH2+]3)C4=CC=CC=C4.[Cl-]
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Product OPENEYE NAME: 2-(8-methyl-8-phenyl-1,4-dioxaspiro[4.5]decan-3-yl)piperidine
CAS Name: 2-(8-methyl-8-phenyl-1,4-dioxaspiro[4.5]decan-3-yl)piperidine
IUPAC NAME: 2-(8-methyl-8-phenyl-1,4-dioxaspiro[4.5]decan-3-yl)piperidine
SYSTEMATIC NAME: 2-(8-methyl-8-phenyl-1,4-dioxaspiro[4.5]decan-3-yl)piperidine
MOLECULAR FORMULA: C20H29NO2
MOLECULAR WEIGHT: 315.44976
SMILES: CC1(CCC2(CC1)OCC(O2)C3CCCCN3)C4=CC=CC=C4
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Product OPENEYE NAME: 2-(2,2-dibenzyl-1,3-dioxolan-4-yl)piperidin-1-ium chloride
CAS Name: 2-[2,2-bis(phenylmethyl)-1,3-dioxolan-4-yl]piperidin-1-ium chloride
IUPAC NAME: 2-(2,2-dibenzyl-1,3-dioxolan-4-yl)piperidin-1-ium chloride
SYSTEMATIC NAME: 2-[2,2-bis(phenylmethyl)-1,3-dioxolan-4-yl]piperidin-1-ium chloride
MOLECULAR FORMULA: C22H28ClNO2
MOLECULAR WEIGHT: 373.91622
SMILES: C1CC[NH2+]C(C1)C2COC(O2)(CC3=CC=CC=C3)CC4=CC=CC=C4.[Cl-]
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Product OPENEYE NAME: 2-(2,2-dibenzyl-1,3-dioxolan-4-yl)piperidine
CAS Name: 2-[2,2-bis(phenylmethyl)-1,3-dioxolan-4-yl]piperidine
IUPAC NAME: 2-(2,2-dibenzyl-1,3-dioxolan-4-yl)piperidine
SYSTEMATIC NAME: 2-[2,2-bis(phenylmethyl)-1,3-dioxolan-4-yl]piperidine
MOLECULAR FORMULA: C22H27NO2
MOLECULAR WEIGHT: 337.45528
SMILES: C1CCNC(C1)C2COC(O2)(CC3=CC=CC=C3)CC4=CC=CC=C4
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Product OPENEYE NAME: 2-(2-ethyl-2-phenyl-1,3-dioxolan-4-yl)piperidin-1-ium chloride
CAS Name: 2-(2-ethyl-2-phenyl-1,3-dioxolan-4-yl)piperidin-1-ium chloride
IUPAC NAME: 2-(2-ethyl-2-phenyl-1,3-dioxolan-4-yl)piperidin-1-ium chloride
SYSTEMATIC NAME: 2-(2-ethyl-2-phenyl-1,3-dioxolan-4-yl)piperidin-1-ium chloride
MOLECULAR FORMULA: C16H24ClNO2
MOLECULAR WEIGHT: 297.82026
SMILES: CCC1(OCC(O1)C2CCCC[NH2+]2)C3=CC=CC=C3.[Cl-]
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Product OPENEYE NAME: 2-(2-ethyl-2-phenyl-1,3-dioxolan-4-yl)piperidine
CAS Name: 2-(2-ethyl-2-phenyl-1,3-dioxolan-4-yl)piperidine
IUPAC NAME: 2-(2-ethyl-2-phenyl-1,3-dioxolan-4-yl)piperidine
SYSTEMATIC NAME: 2-(2-ethyl-2-phenyl-1,3-dioxolan-4-yl)piperidine
MOLECULAR FORMULA: C16H23NO2
MOLECULAR WEIGHT: 261.35932
SMILES: CCC1(OCC(O1)C2CCCCN2)C3=CC=CC=C3
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Product OPENEYE NAME: 2-(2-benzhydryl-2-methyl-1,3-dioxolan-4-yl)piperidin-1-ium chloride
CAS Name: 2-[2-(diphenylmethyl)-2-methyl-1,3-dioxolan-4-yl]piperidin-1-ium chloride
IUPAC NAME: 2-(2-benzhydryl-2-methyl-1,3-dioxolan-4-yl)piperidin-1-ium chloride
SYSTEMATIC NAME: 2-[2-(diphenylmethyl)-2-methyl-1,3-dioxolan-4-yl]piperidin-1-ium chloride
MOLECULAR FORMULA: C22H28ClNO2
MOLECULAR WEIGHT: 373.91622
SMILES: CC1(OCC(O1)C2CCCC[NH2+]2)C(C3=CC=CC=C3)C4=CC=CC=C4.[Cl-]
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