Thursday, July 26, 2012

All Chemical Compounds Information




Product OPENEYE NAME: 1-[(5aS,9aR)-2-hydroxy-4-methoxy-5a-morpholino-7,8,9,9a-tetrahydro-6H-dibenzofuran-1-yl]ethanone
CAS Name: 1-[(5aS,9aR)-2-hydroxy-4-methoxy-5a-(4-morpholinyl)-7,8,9,9a-tetrahydro-6H-dibenzofuran-1-yl]ethanone
IUPAC NAME: 1-[(5aS,9aR)-2-hydroxy-4-methoxy-5a-morpholin-4-yl-7,8,9,9a-tetrahydro-6H-dibenzofuran-1-yl]ethanone
SYSTEMATIC NAME: 1-[(5aS,9aR)-4-methoxy-5a-morpholin-4-yl-2-oxidanyl-7,8,9,9a-tetrahydro-6H-dibenzofuran-1-yl]ethanone
MOLECULAR FORMULA: C19H25NO5
MOLECULAR WEIGHT: 347.4055
SMILES: CC(=O)C1=C2[C@H]3CCCC[C@@]3(OC2=C(C=C1O)OC)N4CCOCC4
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Product OPENEYE NAME: 1-[(5aS,9aR)-2-hydroxy-5a-morpholino-7,8,9,9a-tetrahydro-6H-dibenzofuran-1-yl]propan-1-one
CAS Name: 1-[(5aS,9aR)-2-hydroxy-5a-(4-morpholinyl)-7,8,9,9a-tetrahydro-6H-dibenzofuran-1-yl]-1-propanone
IUPAC NAME: 1-[(5aS,9aR)-2-hydroxy-5a-morpholin-4-yl-7,8,9,9a-tetrahydro-6H-dibenzofuran-1-yl]propan-1-one
SYSTEMATIC NAME: 1-[(5aS,9aR)-5a-morpholin-4-yl-2-oxidanyl-7,8,9,9a-tetrahydro-6H-dibenzofuran-1-yl]propan-1-one
MOLECULAR FORMULA: C19H25NO4
MOLECULAR WEIGHT: 331.4061
SMILES: CCC(=O)C1=C(C=CC2=C1[C@H]3CCCC[C@@]3(O2)N4CCOCC4)O
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Product OPENEYE NAME: 1-[(5aS,10aR)-2-hydroxy-5a-morpholino-6,7,8,9,10,10a-hexahydrocyclohepta[b]benzofuran-1-yl]ethanone
CAS Name: 1-[(5aS,10aR)-2-hydroxy-5a-(4-morpholinyl)-6,7,8,9,10,10a-hexahydrocyclohepta[b]benzofuran-1-yl]ethanone
IUPAC NAME: 1-[(5aS,10aR)-2-hydroxy-5a-morpholin-4-yl-6,7,8,9,10,10a-hexahydrocyclohepta[b][1]benzofuran-1-yl]ethanone
SYSTEMATIC NAME: 1-[(5aS,10aR)-5a-morpholin-4-yl-2-oxidanyl-6,7,8,9,10,10a-hexahydrocyclohepta[b][1]benzofuran-1-yl]ethanone
MOLECULAR FORMULA: C19H25NO4
MOLECULAR WEIGHT: 331.4061
SMILES: CC(=O)C1=C(C=CC2=C1[C@H]3CCCCC[C@@]3(O2)N4CCOCC4)O
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Product OPENEYE NAME: (3-phenoxy-2-thienyl)ammonium
CAS Name: (3-phenoxy-2-thiophenyl)ammonium
IUPAC NAME: (3-phenoxythiophen-2-yl)azanium
SYSTEMATIC NAME: (3-phenoxythiophen-2-yl)azanium
MOLECULAR FORMULA: C10H10NOS+
MOLECULAR WEIGHT: 192.2575
SMILES: C1=CC=C(C=C1)OC2=C(SC=C2)[NH3+]
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Product OPENEYE NAME: 3-phenoxythiophen-2-amine
CAS Name: 3-phenoxy-2-thiophenamine
IUPAC NAME: 3-phenoxythiophen-2-amine
SYSTEMATIC NAME: 3-phenoxythiophen-2-amine
MOLECULAR FORMULA: C10H9NOS
MOLECULAR WEIGHT: 191.24956
SMILES: C1=CC=C(C=C1)OC2=C(SC=C2)N
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Product OPENEYE NAME: thieno[3,2-b][1,4]benzoxazepine
CAS Name: thieno[3,2-b][1,4]benzoxazepine
IUPAC NAME: thieno[3,2-b][1,4]benzoxazepine
SYSTEMATIC NAME: thieno[3,2-b][1,4]benzoxazepine
MOLECULAR FORMULA: C11H7NOS
MOLECULAR WEIGHT: 201.24438
SMILES: C1=CC=C2C(=C1)C=NC3=C(O2)C=CS3
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Product OPENEYE NAME: 1-bromothieno[3,2-b][1,4]benzoxazepine
CAS Name: 1-bromothieno[3,2-b][1,4]benzoxazepine
IUPAC NAME: 1-bromothieno[3,2-b][1,4]benzoxazepine
SYSTEMATIC NAME: 1-bromanylthieno[3,2-b][1,4]benzoxazepine
MOLECULAR FORMULA: C11H6BrNOS
MOLECULAR WEIGHT: 280.14044
SMILES: C1=CC=C2C(=C1)C=NC3=C(O2)C(=CS3)Br
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Product OPENEYE NAME: 2-ethoxycarbonylphenolate
CAS Name: 2-ethoxycarbonylphenolate
IUPAC NAME: 2-ethoxycarbonylphenolate
SYSTEMATIC NAME: 2-ethoxycarbonylphenolate
MOLECULAR FORMULA: C9H9O3-
MOLECULAR WEIGHT: 165.16596
SMILES: CCOC(=O)C1=CC=CC=C1[O-]
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Product OPENEYE NAME: (Z)-(3-oxo-2-thienylidene)methanolate
CAS Name: (Z)-(3-oxo-2-thiophenylidene)methanolate
IUPAC NAME: (Z)-(3-oxothiophen-2-ylidene)methanolate
SYSTEMATIC NAME: (Z)-(3-oxidanylidenethiophen-2-ylidene)methanolate
MOLECULAR FORMULA: C5H3O2S-
MOLECULAR WEIGHT: 127.14112
SMILES: C1=CS/C(=C\[O-])/C1=O
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