Thursday, August 4, 2011

All Chemical Compounds Information




Product OPENEYE NAME: 5,8-dihydroxynaphthalene-1,4-dione
CAS Name: 5,8-dihydroxynaphthalene-1,4-dione
IUPAC NAME: 5,8-dihydroxynaphthalene-1,4-dione
SYSTEMATIC NAME: 5,8-bis(oxidanyl)naphthalene-1,4-dione
MOLECULAR FORMULA: C10H6O4
MOLECULAR WEIGHT: 190.15224
SMILES: C1=CC(=C2C(=O)C=CC(=O)C2=C1O)O
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Product OPENEYE NAME: 5-hydroxy-6-methyl-3-(2,3,5-trihydroxy-4-methyl-6-oxo-cyclohexa-2,4-dien-1-ylidene)cyclohex-5-ene-1,2,4-trione
CAS Name: 5-hydroxy-6-methyl-3-(2,3,5-trihydroxy-4-methyl-6-oxo-1-cyclohexa-2,4-dienylidene)cyclohex-5-ene-1,2,4-trione
IUPAC NAME: 5-hydroxy-6-methyl-3-(2,3,5-trihydroxy-4-methyl-6-oxocyclohexa-2,4-dien-1-ylidene)cyclohex-5-ene-1,2,4-trione
SYSTEMATIC NAME: 6-methyl-3-[4-methyl-2,3,5-tris(oxidanyl)-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene]-5-oxidanyl-cyclohex-5-ene-1,2,4-trione
MOLECULAR FORMULA: C14H10O8
MOLECULAR WEIGHT: 306.2244
SMILES: CC1=C(C(=O)C(=C2C(=O)C(=C(C(=O)C2=O)C)O)C(=C1O)O)O
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MOLECULAR FORMULA: C20H23NO4
MOLECULAR WEIGHT: 341.40092
SMILES: CN1CCC2=CC(=C(C3=C2[C@@H]1CC4=C3C(=C(C=C4)OC)O)OC)OC
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MOLECULAR FORMULA: C17H9NO3
MOLECULAR WEIGHT: 275.25826
SMILES: C1OC2=C(O1)C3=C4C(=C2)C=CN=C4C(=O)C5=CC=CC=C53
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MOLECULAR FORMULA: C21H25NO4
MOLECULAR WEIGHT: 355.4275
SMILES: CN1CCC2=CC(=C(C3=C2C1CC4=CC(=C(C=C43)OC)OC)OC)OC
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MOLECULAR FORMULA: C19H21NO2
MOLECULAR WEIGHT: 295.37554
SMILES: CN1CCC2=CC(=C(C3=C2[C@H]1CC4=CC=CC=C43)OC)OC
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MOLECULAR FORMULA: C20H19NO5
MOLECULAR WEIGHT: 353.36856
SMILES: CN1CC2=C(C=CC3=C2OCO3)C4C1C5=CC6=C(C=C5CC4O)OCO6
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Product OPENEYE NAME: 1,4,5,8-tetrahydroxy-2-methyl-anthracene-9,10-dione
CAS Name: 1,4,5,8-tetrahydroxy-2-methylanthracene-9,10-dione
IUPAC NAME: 1,4,5,8-tetrahydroxy-2-methylanthracene-9,10-dione
SYSTEMATIC NAME: 2-methyl-1,4,5,8-tetrakis(oxidanyl)anthracene-9,10-dione
MOLECULAR FORMULA: C15H10O6
MOLECULAR WEIGHT: 286.2363
SMILES: CC1=CC(=C2C(=C1O)C(=O)C3=C(C=CC(=C3C2=O)O)O)O
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Product OPENEYE NAME: 7-acetonyl-5,8-dihydroxy-2-methoxy-6-methyl-naphthalene-1,4-dione
CAS Name: 5,8-dihydroxy-2-methoxy-6-methyl-7-(2-oxopropyl)naphthalene-1,4-dione
IUPAC NAME: 5,8-dihydroxy-2-methoxy-6-methyl-7-(2-oxopropyl)naphthalene-1,4-dione
SYSTEMATIC NAME: 2-methoxy-6-methyl-5,8-bis(oxidanyl)-7-(2-oxidanylidenepropyl)naphthalene-1,4-dione
MOLECULAR FORMULA: C15H14O6
MOLECULAR WEIGHT: 290.26806
SMILES: CC1=C(C2=C(C(=C1CC(=O)C)O)C(=O)C(=CC2=O)OC)O
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Product OPENEYE NAME: 1,4,5,7-tetrahydroxy-2-methyl-anthracene-9,10-dione
CAS Name: 1,4,5,7-tetrahydroxy-2-methylanthracene-9,10-dione
IUPAC NAME: 1,4,5,7-tetrahydroxy-2-methylanthracene-9,10-dione
SYSTEMATIC NAME: 2-methyl-1,4,5,7-tetrakis(oxidanyl)anthracene-9,10-dione
MOLECULAR FORMULA: C15H10O6
MOLECULAR WEIGHT: 286.2363
SMILES: CC1=CC(=C2C(=C1O)C(=O)C3=CC(=CC(=C3C2=O)O)O)O
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Product OPENEYE NAME: 1,4,5-trihydroxy-2-methyl-anthracene-9,10-dione
CAS Name: 1,4,5-trihydroxy-2-methylanthracene-9,10-dione
IUPAC NAME: 1,4,5-trihydroxy-2-methylanthracene-9,10-dione
SYSTEMATIC NAME: 2-methyl-1,4,5-tris(oxidanyl)anthracene-9,10-dione
MOLECULAR FORMULA: C15H10O5
MOLECULAR WEIGHT: 270.2369
SMILES: CC1=CC(=C2C(=C1O)C(=O)C3=C(C2=O)C(=CC=C3)O)O
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Product OPENEYE NAME: 1,4,5-trihydroxy-7-methoxy-2-methyl-anthracene-9,10-dione
CAS Name: 1,4,5-trihydroxy-7-methoxy-2-methylanthracene-9,10-dione
IUPAC NAME: 1,4,5-trihydroxy-7-methoxy-2-methylanthracene-9,10-dione
SYSTEMATIC NAME: 7-methoxy-2-methyl-1,4,5-tris(oxidanyl)anthracene-9,10-dione
MOLECULAR FORMULA: C16H12O6
MOLECULAR WEIGHT: 300.26288
SMILES: CC1=CC(=C2C(=C1O)C(=O)C3=CC(=CC(=C3C2=O)O)OC)O
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Product OPENEYE NAME:
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MOLECULAR FORMULA: C20H23NO4
MOLECULAR WEIGHT: 341.40092
SMILES: CN1CCC2=CC(=C(C3=C2[C@@H]1CC4=C3C(=C(C=C4)OC)OC)O)OC
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Product OPENEYE NAME:
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MOLECULAR FORMULA: C19H21NO4
MOLECULAR WEIGHT: 327.37434
SMILES: CN1CCC2=CC(=C(C3=C2[C@@H]1CC4=CC(=C(C=C43)OC)O)OC)O
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Product OPENEYE NAME: benzene-1,2,3,4-tetracarboxylic acid
CAS Name: benzene-1,2,3,4-tetracarboxylic acid
IUPAC NAME: benzene-1,2,3,4-tetracarboxylic acid
SYSTEMATIC NAME: benzene-1,2,3,4-tetracarboxylic acid
MOLECULAR FORMULA: C10H6O8
MOLECULAR WEIGHT: 254.14984
SMILES: C1=CC(=C(C(=C1C(=O)O)C(=O)O)C(=O)O)C(=O)O
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