Sunday, July 29, 2012

All Chemical Compounds Information




Product OPENEYE NAME:
CAS Name:
IUPAC NAME:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C24H20BO4-
MOLECULAR WEIGHT: 383.2242
SMILES: [B-]12(OC(C3=C(O1)C=CC4=CC=CC=C43)C)OC(C5=C(O2)C=CC6=CC=CC=C65)C
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Product OPENEYE NAME: 2-amino-N1,N9-bis[13-(hydroxymethyl)-3,10-diisopropyl-7,11-dimethyl-2,5,9,12,15-pentaoxo-8-oxa-1,4,11,14-tetrazabicyclo[14.3.0]nonadecan-6-yl]-4,6-dimethyl-3-oxo-phenoxazine-1,9-dicarboxamide
CAS Name: 2-amino-N1,N9-bis[13-(hydroxymethyl)-7,11-dimethyl-2,5,9,12,15-pentaoxo-3,10-di(propan-2-yl)-8-oxa-1,4,11,14-tetrazabicyclo[14.3.0]nonadecan-6-yl]-4,6-dimethyl-3-oxophenoxazine-1,9-dicarboxamide
IUPAC NAME: 2-amino-1-N,9-N-bis[13-(hydroxymethyl)-7,11-dimethyl-2,5,9,12,15-pentaoxo-3,10-di(propan-2-yl)-8-oxa-1,4,11,14-tetrazabicyclo[14.3.0]nonadecan-6-yl]-4,6-dimethyl-3-oxophenoxazine-1,9-dicarboxamide
SYSTEMATIC NAME: 2-azanyl-N1,N9-bis[13-(hydroxymethyl)-7,11-dimethyl-2,5,9,12,15-pentakis(oxidanylidene)-3,10-di(propan-2-yl)-8-oxa-1,4,11,14-tetrazabicyclo[14.3.0]nonadecan-6-yl]-4,6-dimethyl-3-oxidanylidene-phenoxazine-1,9-dicarboxamide
MOLECULAR FORMULA: C62H86N12O18
MOLECULAR WEIGHT: 1287.41584
SMILES: CC1C(C(=O)NC(C(=O)N2CCCC2C(=O)NC(C(=O)N(C(C(=O)O1)C(C)C)C)CO)C(C)C)NC(=O)C3=C4C(=C(C=C3)C)OC5=C(C(=O)C(=C(C5=N4)C(=O)NC6C(OC(=O)C(N(C(=O)C(NC(=O)C7CCCN7C(=O)C(NC6=O)C(C)C)CO)C)C(C)C)C)N)C
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Product OPENEYE NAME:
CAS Name:
IUPAC NAME:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C62H86N12O18
MOLECULAR WEIGHT: 1287.41584
SMILES: CC1C(C(=O)NC(C(=O)N2CCCC2C(=O)N(CC(=O)N(C(C(=O)O1)C(C)C)C)C)C(C)C)NC(=O)C3=C4C(=C(C=C3)C)OC5=C(C(=C(C(=C5N4)C(=O)NC6C(OC(=O)C(N(C(=O)CN(C(=O)C7CCCN7C(=O)C(NC6=O)C(C)C)C)C)C(C)C)C)[N+](=O)[O-])O)C
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Product OPENEYE NAME: 2-phenyl-3-(4-pyridyl)-2-trimethylsilyloxy-propanenitrile
CAS Name: 2-phenyl-3-pyridin-4-yl-2-trimethylsilyloxypropanenitrile
IUPAC NAME: 2-phenyl-3-pyridin-4-yl-2-trimethylsilyloxypropanenitrile
SYSTEMATIC NAME: 2-phenyl-3-pyridin-4-yl-2-trimethylsilyloxy-propanenitrile
MOLECULAR FORMULA: C17H20N2OSi
MOLECULAR WEIGHT: 296.439
SMILES: C[Si](C)(C)OC(CC1=CC=NC=C1)(C#N)C2=CC=CC=C2
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Product OPENEYE NAME: 3-phenyl-2-(4-pyridyl)-2-trimethylsilyloxy-propanenitrile
CAS Name: 3-phenyl-2-pyridin-4-yl-2-trimethylsilyloxypropanenitrile
IUPAC NAME: 3-phenyl-2-pyridin-4-yl-2-trimethylsilyloxypropanenitrile
SYSTEMATIC NAME: 3-phenyl-2-pyridin-4-yl-2-trimethylsilyloxy-propanenitrile
MOLECULAR FORMULA: C17H20N2OSi
MOLECULAR WEIGHT: 296.439
SMILES: C[Si](C)(C)OC(CC1=CC=CC=C1)(C#N)C2=CC=NC=C2
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Product OPENEYE NAME: 2-phenyl-3-(3-pyridyl)-2-trimethylsilyloxy-propanenitrile
CAS Name: 2-phenyl-3-(3-pyridinyl)-2-trimethylsilyloxypropanenitrile
IUPAC NAME: 2-phenyl-3-pyridin-3-yl-2-trimethylsilyloxypropanenitrile
SYSTEMATIC NAME: 2-phenyl-3-pyridin-3-yl-2-trimethylsilyloxy-propanenitrile
MOLECULAR FORMULA: C17H20N2OSi
MOLECULAR WEIGHT: 296.439
SMILES: C[Si](C)(C)OC(CC1=CN=CC=C1)(C#N)C2=CC=CC=C2
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Product OPENEYE NAME: 3-phenyl-2-(2-pyridyl)-2-trimethylsilyloxy-propanenitrile
CAS Name: 3-phenyl-2-(2-pyridinyl)-2-trimethylsilyloxypropanenitrile
IUPAC NAME: 3-phenyl-2-pyridin-2-yl-2-trimethylsilyloxypropanenitrile
SYSTEMATIC NAME: 3-phenyl-2-pyridin-2-yl-2-trimethylsilyloxy-propanenitrile
MOLECULAR FORMULA: C17H20N2OSi
MOLECULAR WEIGHT: 296.439
SMILES: C[Si](C)(C)OC(CC1=CC=CC=C1)(C#N)C2=CC=CC=N2
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Product OPENEYE NAME: 1,3-dimethyl-6-phenyl-3-azabicyclo[4.2.1]nonan-9-one
CAS Name: 1,3-dimethyl-6-phenyl-3-azabicyclo[4.2.1]nonan-9-one
IUPAC NAME: 1,3-dimethyl-6-phenyl-3-azabicyclo[4.2.1]nonan-9-one
SYSTEMATIC NAME: 1,3-dimethyl-6-phenyl-3-azabicyclo[4.2.1]nonan-9-one
MOLECULAR FORMULA: C16H21NO
MOLECULAR WEIGHT: 243.34404
SMILES: CC12CCC(C1=O)(CCN(C2)C)C3=CC=CC=C3
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Product OPENEYE NAME: 5-[(dimethylamino)methyl]-2-(2-hydroxyethyl)-2-phenyl-cyclopentanone
CAS Name: 5-[(dimethylamino)methyl]-2-(2-hydroxyethyl)-2-phenyl-1-cyclopentanone
IUPAC NAME: 5-[(dimethylamino)methyl]-2-(2-hydroxyethyl)-2-phenylcyclopentan-1-one
SYSTEMATIC NAME: 5-[(dimethylamino)methyl]-2-(2-hydroxyethyl)-2-phenyl-cyclopentan-1-one
MOLECULAR FORMULA: C16H23NO2
MOLECULAR WEIGHT: 261.35932
SMILES: CN(C)CC1CCC(C1=O)(CCO)C2=CC=CC=C2
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Product OPENEYE NAME: 1-(3-nitrophenyl)-2-(4-nitrophenyl)ethane-1,2-dione
CAS Name: 1-(3-nitrophenyl)-2-(4-nitrophenyl)ethane-1,2-dione
IUPAC NAME: 1-(3-nitrophenyl)-2-(4-nitrophenyl)ethane-1,2-dione
SYSTEMATIC NAME: 1-(3-nitrophenyl)-2-(4-nitrophenyl)ethane-1,2-dione
MOLECULAR FORMULA: C14H8N2O6
MOLECULAR WEIGHT: 300.22312
SMILES: C1=CC(=CC(=C1)[N+](=O)[O-])C(=O)C(=O)C2=CC=C(C=C2)[N+](=O)[O-]
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Product OPENEYE NAME: 4,6-dinitro-2-oxido-3-phenyl-1,2-benzoxazol-2-ium
CAS Name: 4,6-dinitro-2-oxido-3-phenyl-1,2-benzoxazol-2-ium
IUPAC NAME: 4,6-dinitro-2-oxido-3-phenyl-1,2-benzoxazol-2-ium
SYSTEMATIC NAME: 4,6-dinitro-2-oxidanidyl-3-phenyl-1,2-benzoxazol-2-ium
MOLECULAR FORMULA: C13H7N3O6
MOLECULAR WEIGHT: 301.21118
SMILES: C1=CC=C(C=C1)C2=[N+](OC3=CC(=CC(=C32)[N+](=O)[O-])[N+](=O)[O-])[O-]
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Product OPENEYE NAME: 3-methyl-6-nitro-2-oxido-1,2-benzoxazol-2-ium
CAS Name: 3-methyl-6-nitro-2-oxido-1,2-benzoxazol-2-ium
IUPAC NAME: 3-methyl-6-nitro-2-oxido-1,2-benzoxazol-2-ium
SYSTEMATIC NAME: 3-methyl-6-nitro-2-oxidanidyl-1,2-benzoxazol-2-ium
MOLECULAR FORMULA: C8H6N2O4
MOLECULAR WEIGHT: 194.14424
SMILES: CC1=[N+](OC2=C1C=CC(=C2)[N+](=O)[O-])[O-]
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Product OPENEYE NAME: methyl 2-(1-hydroxy-6,6,9-trimethyl-7,8,9,10-tetrahydrobenzo[c]chromen-3-yl)propanoate
CAS Name: 2-(1-hydroxy-6,6,9-trimethyl-7,8,9,10-tetrahydrobenzo[c][1]benzopyran-3-yl)propanoic acid methyl ester
IUPAC NAME: methyl 2-(1-hydroxy-6,6,9-trimethyl-7,8,9,10-tetrahydrobenzo[c]chromen-3-yl)propanoate
SYSTEMATIC NAME: methyl 2-(6,6,9-trimethyl-1-oxidanyl-7,8,9,10-tetrahydrobenzo[c]chromen-3-yl)propanoate
MOLECULAR FORMULA: C20H26O4
MOLECULAR WEIGHT: 330.41804
SMILES: CC1CCC2=C(C1)C3=C(C=C(C=C3O)C(C)C(=O)OC)OC2(C)C
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