Saturday, August 27, 2011

All Chemical Compounds Information




Product OPENEYE NAME: 2-[2-[2-[2-(2-dodecoxyethoxy)ethoxy]ethoxy]ethoxy]ethanol
CAS Name: 2-[2-[2-[2-(2-dodecoxyethoxy)ethoxy]ethoxy]ethoxy]ethanol
IUPAC NAME: 2-[2-[2-[2-(2-dodecoxyethoxy)ethoxy]ethoxy]ethoxy]ethanol
SYSTEMATIC NAME: 2-[2-[2-[2-(2-dodecoxyethoxy)ethoxy]ethoxy]ethoxy]ethanol
MOLECULAR FORMULA: C22H46O6
MOLECULAR WEIGHT: 406.59704
SMILES: CCCCCCCCCCCCOCCOCCOCCOCCOCCO
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Product OPENEYE NAME: 2-[2-[2-[2-[2-(2-dodecoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethanol
CAS Name: 2-[2-[2-[2-[2-(2-dodecoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethanol
IUPAC NAME: 2-[2-[2-[2-[2-(2-dodecoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethanol
SYSTEMATIC NAME: 2-[2-[2-[2-[2-(2-dodecoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethanol
MOLECULAR FORMULA: C24H50O7
MOLECULAR WEIGHT: 450.6496
SMILES: CCCCCCCCCCCCOCCOCCOCCOCCOCCOCCO
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Product OPENEYE NAME: 1-[(2R,5S)-5-(hydroxymethyl)-2,5-dihydrofuran-2-yl]-5-methyl-pyrimidine-2,4-dione
CAS Name: 1-[(2R,5S)-5-(hydroxymethyl)-2,5-dihydrofuran-2-yl]-5-methylpyrimidine-2,4-dione
IUPAC NAME: 1-[(2R,5S)-5-(hydroxymethyl)-2,5-dihydrofuran-2-yl]-5-methylpyrimidine-2,4-dione
SYSTEMATIC NAME: 1-[(2R,5S)-5-(hydroxymethyl)-2,5-dihydrofuran-2-yl]-5-methyl-pyrimidine-2,4-dione
MOLECULAR FORMULA: C10H12N2O4
MOLECULAR WEIGHT: 224.21328
SMILES: CC1=CN(C(=O)NC1=O)[C@H]2C=C[C@H](O2)CO
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Product OPENEYE NAME: 1,3,3-trimethyl-2-[2-(2-methyl-1H-indol-3-yl)vinyl]indol-1-ium
CAS Name: 1,3,3-trimethyl-2-[2-(2-methyl-1H-indol-3-yl)ethenyl]indol-1-ium
IUPAC NAME: 1,3,3-trimethyl-2-[2-(2-methyl-1H-indol-3-yl)ethenyl]indol-1-ium
SYSTEMATIC NAME: 1,3,3-trimethyl-2-[2-(2-methyl-1H-indol-3-yl)ethenyl]indol-1-ium
MOLECULAR FORMULA: C22H23N2+
MOLECULAR WEIGHT: 315.43142
SMILES: CC1=C(C2=CC=CC=C2N1)C=CC3=[N+](C4=CC=CC=C4C3(C)C)C
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Product OPENEYE NAME: 2,4,6-trinitrobenzene-1,3,5-triamine
CAS Name: 2,4,6-trinitrobenzene-1,3,5-triamine
IUPAC NAME: 2,4,6-trinitrobenzene-1,3,5-triamine
SYSTEMATIC NAME: 2,4,6-trinitrobenzene-1,3,5-triamine
MOLECULAR FORMULA: C6H6N6O6
MOLECULAR WEIGHT: 258.14844
SMILES: C1(=C(C(=C(C(=C1[N+](=O)[O-])N)[N+](=O)[O-])N)[N+](=O)[O-])N
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Product OPENEYE NAME: (3-carboxy-2-phenyl-propyl)ammonium chloride
CAS Name: (3-carboxy-2-phenylpropyl)ammonium chloride
IUPAC NAME: (3-carboxy-2-phenylpropyl)azanium chloride
SYSTEMATIC NAME: (4-oxidanyl-4-oxidanylidene-2-phenyl-butyl)azanium chloride
MOLECULAR FORMULA: C10H14ClNO2
MOLECULAR WEIGHT: 215.67666
SMILES: C1=CC=C(C=C1)C(CC(=O)O)C[NH3+].[Cl-]
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Product OPENEYE NAME: 2-amino-2,2-diphenyl-acetic acid
CAS Name: 2-amino-2,2-diphenylacetic acid
IUPAC NAME: 2-amino-2,2-diphenylacetic acid
SYSTEMATIC NAME: 2-azanyl-2,2-diphenyl-ethanoic acid
MOLECULAR FORMULA: C14H13NO2
MOLECULAR WEIGHT: 227.25852
SMILES: C1=CC=C(C=C1)C(C2=CC=CC=C2)(C(=O)O)N
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Product OPENEYE NAME: 3-(4-bromophenyl)-1-methoxy-1-methyl-urea
CAS Name: 3-(4-bromophenyl)-1-methoxy-1-methylurea
IUPAC NAME: 3-(4-bromophenyl)-1-methoxy-1-methylurea
SYSTEMATIC NAME: 3-(4-bromophenyl)-1-methoxy-1-methyl-urea
MOLECULAR FORMULA: C9H11BrN2O2
MOLECULAR WEIGHT: 259.09984
SMILES: CN(C(=O)NC1=CC=C(C=C1)Br)OC
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Product OPENEYE NAME: 1-cyanovinyl acetate
CAS Name: acetic acid 1-cyanoethenyl ester
IUPAC NAME: 1-cyanoethenyl acetate
SYSTEMATIC NAME: 1-cyanoethenyl ethanoate
MOLECULAR FORMULA: C5H5NO2
MOLECULAR WEIGHT: 111.0987
SMILES: CC(=O)OC(=C)C#N
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Product OPENEYE NAME: (2R,4S,5R,6R)-5-acetamido-2-[[(2R,3S,4R,5R)-5-(4-amino-2-oxo-pyrimidin-1-yl)-3,4-dihydroxy-tetrahydrofuran-2-yl]methoxy-hydroxy-phosphoryl]oxy-4-hydroxy-6-(1,2,3-trihydroxypropyl)tetrahydropyran-2-carboxylic acid
CAS Name: (2R,4S,5R,6R)-5-acetamido-2-[[(2R,3S,4R,5R)-5-(4-amino-2-oxo-1-pyrimidinyl)-3,4-dihydroxy-2-oxolanyl]methoxy-hydroxyphosphoryl]oxy-4-hydroxy-6-(1,2,3-trihydroxypropyl)-2-oxanecarboxylic acid
IUPAC NAME: (2R,4S,5R,6R)-5-acetamido-2-[[(2R,3S,4R,5R)-5-(4-amino-2-oxopyrimidin-1-yl)-3,4-dihydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl]oxy-4-hydroxy-6-(1,2,3-trihydroxypropyl)oxane-2-carboxylic acid
SYSTEMATIC NAME: (2R,4S,5R,6R)-5-acetamido-2-[[(2R,3S,4R,5R)-5-(4-azanyl-2-oxidanylidene-pyrimidin-1-yl)-3,4-bis(oxidanyl)oxolan-2-yl]methoxy-oxidanyl-phosphoryl]oxy-4-oxidanyl-6-[1,2,3-tris(oxidanyl)propyl]oxane-2-carboxylic acid
MOLECULAR FORMULA: C20H31N4O16P
MOLECULAR WEIGHT: 614.451101
SMILES: CC(=O)N[C@@H]1[C@H](C[C@](O[C@H]1C(C(CO)O)O)(C(=O)O)OP(=O)(O)OC[C@@H]2[C@H]([C@H]([C@@H](O2)N3C=CC(=NC3=O)N)O)O)O
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