Thursday, August 4, 2011

All Chemical Compounds Information




Product OPENEYE NAME: (1R,3S)-9-methoxy-1,3-dimethyl-3,4-dihydro-1H-benzo[g]isochromene-5,10-dione
CAS Name: (1R,3S)-9-methoxy-1,3-dimethyl-3,4-dihydro-1H-benzo[g][2]benzopyran-5,10-dione
IUPAC NAME: (1R,3S)-9-methoxy-1,3-dimethyl-3,4-dihydro-1H-benzo[g]isochromene-5,10-dione
SYSTEMATIC NAME: (1R,3S)-9-methoxy-1,3-dimethyl-3,4-dihydro-1H-benzo[g]isochromene-5,10-dione
MOLECULAR FORMULA: C16H16O4
MOLECULAR WEIGHT: 272.29584
SMILES: C[C@H]1CC2=C([C@H](O1)C)C(=O)C3=C(C2=O)C=CC=C3OC
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Product OPENEYE NAME: 4-hydroxy-9-methoxy-7-methyl-furo[3,2-g]chromen-5-one
CAS Name: 4-hydroxy-9-methoxy-7-methyl-5-furo[3,2-g][1]benzopyranone
IUPAC NAME: 4-hydroxy-9-methoxy-7-methylfuro[3,2-g]chromen-5-one
SYSTEMATIC NAME: 9-methoxy-7-methyl-4-oxidanyl-furo[3,2-g]chromen-5-one
MOLECULAR FORMULA: C13H10O5
MOLECULAR WEIGHT: 246.2155
SMILES: CC1=CC(=O)C2=C(C3=C(C(=C2O1)OC)OC=C3)O
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Product OPENEYE NAME: 4,5-dihydroxy-9,10-dioxo-anthracene-2-carboxylic acid
CAS Name: 4,5-dihydroxy-9,10-dioxo-2-anthracenecarboxylic acid
IUPAC NAME: 4,5-dihydroxy-9,10-dioxoanthracene-2-carboxylic acid
SYSTEMATIC NAME: 4,5-bis(oxidanyl)-9,10-bis(oxidanylidene)anthracene-2-carboxylic acid
MOLECULAR FORMULA: C15H8O6
MOLECULAR WEIGHT: 284.22042
SMILES: C1=CC2=C(C(=C1)O)C(=O)C3=C(C=C(C=C3C2=O)C(=O)O)O
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Product OPENEYE NAME: 4,5,7-trihydroxy-9,10-dioxo-anthracene-1-carboxylic acid
CAS Name: 4,5,7-trihydroxy-9,10-dioxo-1-anthracenecarboxylic acid
IUPAC NAME: 4,5,7-trihydroxy-9,10-dioxoanthracene-1-carboxylic acid
SYSTEMATIC NAME: 4,5,7-tris(oxidanyl)-9,10-bis(oxidanylidene)anthracene-1-carboxylic acid
MOLECULAR FORMULA: C15H8O7
MOLECULAR WEIGHT: 300.21982
SMILES: C1=CC(=C2C(=C1C(=O)O)C(=O)C3=CC(=CC(=C3C2=O)O)O)O
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Product OPENEYE NAME:
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MOLECULAR FORMULA: C37H40N2O6
MOLECULAR WEIGHT: 608.7233
SMILES: CN1CCC2=CC(=C3C=C2C1CC4=CC=C(C=C4)OC5=C(C=CC(=C5)CC6C7=C(O3)C(=C(C=C7CCN6C)OC)OC)O)OC
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Product OPENEYE NAME:
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MOLECULAR FORMULA: C20H24BrN3O
MOLECULAR WEIGHT: 402.32806
SMILES: CCN(CC)C(=O)[C@H]1CN([C@@H]2CC3=C(NC4=CC=CC(=C34)C2=C1)Br)C
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Product OPENEYE NAME:
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MOLECULAR FORMULA: C15H15NO2
MOLECULAR WEIGHT: 241.2851
SMILES: C1CN2CCC3=CC=CC(=C32)C4=C1COC(=O)C4
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MOLECULAR FORMULA: C16H17N3O
MOLECULAR WEIGHT: 267.32568
SMILES: CN1CC(C=C2C1CC3=CNC4=CC=CC2=C34)C(=O)N
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Product OPENEYE NAME: (2,6-dihydroxy-4-methoxy-phenyl)-phenyl-methanone
CAS Name: (2,6-dihydroxy-4-methoxyphenyl)-phenylmethanone
IUPAC NAME: (2,6-dihydroxy-4-methoxyphenyl)-phenylmethanone
SYSTEMATIC NAME: [4-methoxy-2,6-bis(oxidanyl)phenyl]-phenyl-methanone
MOLECULAR FORMULA: C14H12O4
MOLECULAR WEIGHT: 244.24268
SMILES: COC1=CC(=C(C(=C1)O)C(=O)C2=CC=CC=C2)O
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Product OPENEYE NAME: 1,2-dihydrobenzo[j]aceanthrylene
CAS Name: 1,2-dihydrobenzo[j]aceanthrylene
IUPAC NAME: 1,2-dihydrobenzo[j]aceanthrylene
SYSTEMATIC NAME: 1,2-dihydrobenzo[j]aceanthrylene
MOLECULAR FORMULA: C20H14
MOLECULAR WEIGHT: 254.32516
SMILES: C1CC2=C3C1=CC=CC3=CC4=C2C=CC5=CC=CC=C54
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Product OPENEYE NAME: N-methyl-N-(2,4,6-trinitrophenyl)nitramide
CAS Name: N-methyl-N-(2,4,6-trinitrophenyl)nitramide
IUPAC NAME: N-methyl-N-(2,4,6-trinitrophenyl)nitramide
SYSTEMATIC NAME: N-methyl-N-(2,4,6-trinitrophenyl)nitramide
MOLECULAR FORMULA: C7H5N5O8
MOLECULAR WEIGHT: 287.1433
SMILES: CN(C1=C(C=C(C=C1[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-]
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