Friday, December 30, 2011

All Chemical Compounds Information




Product OPENEYE NAME: (4-benzylpiperazin-1-yl)-(5-iodanyl-3-pyridyl)methanone
CAS Name: (5-iodanyl-3-pyridinyl)-[4-(phenylmethyl)-1-piperazinyl]methanone
IUPAC NAME: (4-benzylpiperazin-1-yl)-(5-iodanylpyridin-3-yl)methanone
SYSTEMATIC NAME: (5-iodanylpyridin-3-yl)-[4-(phenylmethyl)piperazin-1-yl]methanone
MOLECULAR FORMULA: C17H18IN3O
MOLECULAR WEIGHT: 403.249918
SMILES: C1CN(CCN1CC2=CC=CC=C2)C(=O)C3=CC(=CN=C3)[123I]
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Product OPENEYE NAME: [4-[(4-iodanylphenyl)methyl]piperazin-1-yl]-(3-quinolyl)methanone
CAS Name: [4-[(4-iodanylphenyl)methyl]-1-piperazinyl]-(3-quinolinyl)methanone
IUPAC NAME: [4-[(4-iodanylphenyl)methyl]piperazin-1-yl]-quinolin-3-ylmethanone
SYSTEMATIC NAME: [4-[(4-iodanylphenyl)methyl]piperazin-1-yl]-quinolin-3-yl-methanone
MOLECULAR FORMULA: C21H20IN3O
MOLECULAR WEIGHT: 453.308598
SMILES: C1CN(CCN1CC2=CC=C(C=C2)[123I])C(=O)C3=CC4=CC=CC=C4N=C3
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MOLECULAR FORMULA: C33H47NO4
MOLECULAR WEIGHT: 521.73058
SMILES: CCCCCCCCCCCC(=O)OC1=C2C3=C(C[C@@H]4[C@]5([C@]3(CCN4CC6CC6)[C@@H](O2)C(=C)CC5)O)C=C1
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MOLECULAR FORMULA: C37H55NO4
MOLECULAR WEIGHT: 577.8369
SMILES: CCCCCCCCCCCCCCCC(=O)OC1=C2C3=C(C[C@@H]4[C@]5([C@]3(CCN4CC6CC6)[C@@H](O2)C(=C)CC5)O)C=C1
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MOLECULAR FORMULA: C29H39NO4
MOLECULAR WEIGHT: 465.62426
SMILES: CCCCCCCC(=O)OC1=C2C3=C(C[C@@H]4[C@]5([C@]3(CCN4CC6CC6)[C@@H](O2)C(=C)CC5)O)C=C1
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Product OPENEYE NAME: 5-deuterio-5-[dideuterio-(2,4,6-trideuterio-3,5-dimethyl-phenoxy)methyl]oxazolidin-2-one
CAS Name: 5-deuterio-5-[dideuterio-(2,4,6-trideuterio-3,5-dimethylphenoxy)methyl]-2-oxazolidinone
IUPAC NAME: 5-deuterio-5-[dideuterio-(2,4,6-trideuterio-3,5-dimethylphenoxy)methyl]-1,3-oxazolidin-2-one
SYSTEMATIC NAME: 5-deuterio-5-[dideuterio-(2,4,6-trideuterio-3,5-dimethyl-phenoxy)methyl]-1,3-oxazolidin-2-one
MOLECULAR FORMULA: C12H15NO3
MOLECULAR WEIGHT: 227.289371
SMILES: [2H]C1=C(C(=C(C(=C1C)[2H])OC([2H])([2H])C2(CNC(=O)O2)[2H])[2H])C
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Product OPENEYE NAME: 5-deuterio-5-[dideuterio-[2,4,6-trideuterio-3,5-bis(trideuteriomethyl)phenoxy]methyl]oxazolidin-2-one
CAS Name: 5-deuterio-5-[dideuterio-[2,4,6-trideuterio-3,5-bis(trideuteriomethyl)phenoxy]methyl]-2-oxazolidinone
IUPAC NAME: 5-deuterio-5-[dideuterio-[2,4,6-trideuterio-3,5-bis(trideuteriomethyl)phenoxy]methyl]-1,3-oxazolidin-2-one
SYSTEMATIC NAME: 5-deuterio-5-[dideuterio-[2,4,6-trideuterio-3,5-bis(trideuteriomethyl)phenoxy]methyl]-1,3-oxazolidin-2-one
MOLECULAR FORMULA: C12H15NO3
MOLECULAR WEIGHT: 233.326341
SMILES: [2H]C1=C(C(=C(C(=C1C([2H])([2H])[2H])[2H])OC([2H])([2H])C2(CNC(=O)O2)[2H])[2H])C([2H])([2H])[2H]
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Product OPENEYE NAME: 4,4-dideuterio-5-[(3,5-dimethylphenoxy)methyl]oxazolidin-2-one
CAS Name: 4,4-dideuterio-5-[(3,5-dimethylphenoxy)methyl]-2-oxazolidinone
IUPAC NAME: 4,4-dideuterio-5-[(3,5-dimethylphenoxy)methyl]-1,3-oxazolidin-2-one
SYSTEMATIC NAME: 4,4-dideuterio-5-[(3,5-dimethylphenoxy)methyl]-1,3-oxazolidin-2-one
MOLECULAR FORMULA: C12H15NO3
MOLECULAR WEIGHT: 223.264724
SMILES: [2H]C1(C(OC(=O)N1)COC2=CC(=CC(=C2)C)C)[2H]
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Product OPENEYE NAME: 5-[[3,5-bis(trideuteriomethyl)phenoxy]methyl]-4,4-dideuterio-oxazolidin-2-one
CAS Name: 5-[[3,5-bis(trideuteriomethyl)phenoxy]methyl]-4,4-dideuterio-2-oxazolidinone
IUPAC NAME: 5-[[3,5-bis(trideuteriomethyl)phenoxy]methyl]-4,4-dideuterio-1,3-oxazolidin-2-one
SYSTEMATIC NAME: 5-[[3,5-bis(trideuteriomethyl)phenoxy]methyl]-4,4-dideuterio-1,3-oxazolidin-2-one
MOLECULAR FORMULA: C12H15NO3
MOLECULAR WEIGHT: 229.301694
SMILES: [2H]C1(C(OC(=O)N1)COC2=CC(=CC(=C2)C([2H])([2H])[2H])C([2H])([2H])[2H])[2H]
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Product OPENEYE NAME: 4,4-dideuterio-5-[(2,4,6-trideuterio-3,5-dimethyl-phenoxy)methyl]oxazolidin-2-one
CAS Name: 4,4-dideuterio-5-[(2,4,6-trideuterio-3,5-dimethylphenoxy)methyl]-2-oxazolidinone
IUPAC NAME: 4,4-dideuterio-5-[(2,4,6-trideuterio-3,5-dimethylphenoxy)methyl]-1,3-oxazolidin-2-one
SYSTEMATIC NAME: 4,4-dideuterio-5-[(2,4,6-trideuterio-3,5-dimethyl-phenoxy)methyl]-1,3-oxazolidin-2-one
MOLECULAR FORMULA: C12H15NO3
MOLECULAR WEIGHT: 226.283209
SMILES: [2H]C1=C(C(=C(C(=C1C)[2H])OCC2C(NC(=O)O2)([2H])[2H])[2H])C
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Product OPENEYE NAME: 4,4-dideuterio-5-[[2,4,6-trideuterio-3,5-bis(trideuteriomethyl)phenoxy]methyl]oxazolidin-2-one
CAS Name: 4,4-dideuterio-5-[[2,4,6-trideuterio-3,5-bis(trideuteriomethyl)phenoxy]methyl]-2-oxazolidinone
IUPAC NAME: 4,4-dideuterio-5-[[2,4,6-trideuterio-3,5-bis(trideuteriomethyl)phenoxy]methyl]-1,3-oxazolidin-2-one
SYSTEMATIC NAME: 4,4-dideuterio-5-[[2,4,6-trideuterio-3,5-bis(trideuteriomethyl)phenoxy]methyl]-1,3-oxazolidin-2-one
MOLECULAR FORMULA: C12H15NO3
MOLECULAR WEIGHT: 232.32018
SMILES: [2H]C1=C(C(=C(C(=C1C([2H])([2H])[2H])[2H])OCC2C(NC(=O)O2)([2H])[2H])[2H])C([2H])([2H])[2H]
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Product OPENEYE NAME: 4,4-dideuterio-5-[dideuterio-(3,5-dimethylphenoxy)methyl]oxazolidin-2-one
CAS Name: 4,4-dideuterio-5-[dideuterio-(3,5-dimethylphenoxy)methyl]-2-oxazolidinone
IUPAC NAME: 4,4-dideuterio-5-[dideuterio-(3,5-dimethylphenoxy)methyl]-1,3-oxazolidin-2-one
SYSTEMATIC NAME: 4,4-dideuterio-5-[dideuterio-(3,5-dimethylphenoxy)methyl]-1,3-oxazolidin-2-one
MOLECULAR FORMULA: C12H15NO3
MOLECULAR WEIGHT: 225.277047
SMILES: [2H]C1(C(OC(=O)N1)C([2H])([2H])OC2=CC(=CC(=C2)C)C)[2H]
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