Tuesday, September 4, 2012

All Chemical Compounds Information




Product OPENEYE NAME:
CAS Name:
IUPAC NAME:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C22H15N3O
MOLECULAR WEIGHT: 337.374
SMILES: C1CN2C(=NC3=CC=CC=C3C2=O)C4=C1C5=C(N4)C=CC6=CC=CC=C65
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Product OPENEYE NAME:
CAS Name:
IUPAC NAME:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C19H15N3O
MOLECULAR WEIGHT: 301.3419
SMILES: CC1CC2=C(C3=NC4=CC=CC=C4C(=O)N13)NC5=CC=CC=C25
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Product OPENEYE NAME:
CAS Name:
IUPAC NAME:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C19H15N3O
MOLECULAR WEIGHT: 301.3419
SMILES: CC1=CC2=C(C=C1)NC3=C2CCN4C3=NC5=CC=CC=C5C4=O
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Product OPENEYE NAME:
CAS Name:
IUPAC NAME:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C18H12FN3O
MOLECULAR WEIGHT: 305.305783
SMILES: C1CN2C(=NC3=CC=CC=C3C2=O)C4=C1C5=C(N4)C=CC(=C5)F
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Product OPENEYE NAME:
CAS Name:
IUPAC NAME:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C18H12ClN3O
MOLECULAR WEIGHT: 321.76038
SMILES: C1CN2C(=NC3=CC=CC=C3C2=O)C4=C1C5=C(N4)C=CC(=C5)Cl
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Product OPENEYE NAME:
CAS Name:
IUPAC NAME:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C24H17N3O2
MOLECULAR WEIGHT: 379.41068
SMILES: C1CN2C(=NC3=CC=CC=C3C2=O)C4=C1C5=C(N4)C=CC(=C5)OC6=CC=CC=C6
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Product OPENEYE NAME: (3Z)-1-benzyl-3-(1-benzylpyrrolidin-2-ylidene)pyrrolidin-2-one
CAS Name: (3Z)-1-(phenylmethyl)-3-[1-(phenylmethyl)-2-pyrrolidinylidene]-2-pyrrolidinone
IUPAC NAME: (3Z)-1-benzyl-3-(1-benzylpyrrolidin-2-ylidene)pyrrolidin-2-one
SYSTEMATIC NAME: (3Z)-1-(phenylmethyl)-3-[1-(phenylmethyl)pyrrolidin-2-ylidene]pyrrolidin-2-one
MOLECULAR FORMULA: C22H24N2O
MOLECULAR WEIGHT: 332.43876
SMILES: C1C/C(=C/2\CCN(C2=O)CC3=CC=CC=C3)/N(C1)CC4=CC=CC=C4
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Product OPENEYE NAME: 2-isopropyl-2,3-dihydrobenzofuran
CAS Name: 2-propan-2-yl-2,3-dihydrobenzofuran
IUPAC NAME: 2-propan-2-yl-2,3-dihydro-1-benzofuran
SYSTEMATIC NAME: 2-propan-2-yl-2,3-dihydro-1-benzofuran
MOLECULAR FORMULA: C11H14O
MOLECULAR WEIGHT: 162.22826
SMILES: CC(C)C1CC2=CC=CC=C2O1
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Product OPENEYE NAME: 1-methyl-4,7-dihydroindole
CAS Name: 1-methyl-4,7-dihydroindole
IUPAC NAME: 1-methyl-4,7-dihydroindole
SYSTEMATIC NAME: 1-methyl-4,7-dihydroindole
MOLECULAR FORMULA: C9H11N
MOLECULAR WEIGHT: 133.19034
SMILES: CN1C=CC2=C1CC=CC2
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Product OPENEYE NAME: 4,7-dihydrobenzofuran
CAS Name: 4,7-dihydrobenzofuran
IUPAC NAME: 4,7-dihydro-1-benzofuran
SYSTEMATIC NAME: 4,7-dihydro-1-benzofuran
MOLECULAR FORMULA: C8H8O
MOLECULAR WEIGHT: 120.14852
SMILES: C1C=CCC2=C1C=CO2
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