Monday, April 29, 2013

All Chemical Compounds Information




Product OPENEYE NAME: [2-nitro-6-[(E)-prop-2-ynoxyiminomethyl]phenyl] N-methylcarbamate
CAS Name: N-methylcarbamic acid [2-nitro-6-[(E)-prop-2-ynoxyiminomethyl]phenyl] ester
IUPAC NAME: [2-nitro-6-[(E)-prop-2-ynoxyiminomethyl]phenyl] N-methylcarbamate
SYSTEMATIC NAME: [2-nitro-6-[(E)-prop-2-ynoxyiminomethyl]phenyl] N-methylcarbamate
MOLECULAR FORMULA: C12H11N3O5
MOLECULAR WEIGHT: 277.23284
SMILES: CNC(=O)OC1=C(C=CC=C1[N+](=O)[O-])/C=N/OCC#C
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Product OPENEYE NAME: [2,4-dichloro-6-[(E)-prop-2-ynoxyiminomethyl]phenyl] N-methylcarbamate
CAS Name: N-methylcarbamic acid [2,4-dichloro-6-[(E)-prop-2-ynoxyiminomethyl]phenyl] ester
IUPAC NAME: [2,4-dichloro-6-[(E)-prop-2-ynoxyiminomethyl]phenyl] N-methylcarbamate
SYSTEMATIC NAME: [2,4-bis(chloranyl)-6-[(E)-prop-2-ynoxyiminomethyl]phenyl] N-methylcarbamate
MOLECULAR FORMULA: C12H10Cl2N2O3
MOLECULAR WEIGHT: 301.1254
SMILES: CNC(=O)OC1=C(C=C(C=C1/C=N/OCC#C)Cl)Cl
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Product OPENEYE NAME: [2,4-dibromo-6-[(E)-prop-2-ynoxyiminomethyl]phenyl] N-methylcarbamate
CAS Name: N-methylcarbamic acid [2,4-dibromo-6-[(E)-prop-2-ynoxyiminomethyl]phenyl] ester
IUPAC NAME: [2,4-dibromo-6-[(E)-prop-2-ynoxyiminomethyl]phenyl] N-methylcarbamate
SYSTEMATIC NAME: [2,4-bis(bromanyl)-6-[(E)-prop-2-ynoxyiminomethyl]phenyl] N-methylcarbamate
MOLECULAR FORMULA: C12H10Br2N2O3
MOLECULAR WEIGHT: 390.0274
SMILES: CNC(=O)OC1=C(C=C(C=C1/C=N/OCC#C)Br)Br
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Product OPENEYE NAME: [4-chloro-2-[(E)-prop-2-ynoxyiminomethyl]phenyl] acetate
CAS Name: acetic acid [4-chloro-2-[(E)-prop-2-ynoxyiminomethyl]phenyl] ester
IUPAC NAME: [4-chloro-2-[(E)-prop-2-ynoxyiminomethyl]phenyl] acetate
SYSTEMATIC NAME: [4-chloranyl-2-[(E)-prop-2-ynoxyiminomethyl]phenyl] ethanoate
MOLECULAR FORMULA: C12H10ClNO3
MOLECULAR WEIGHT: 251.6657
SMILES: CC(=O)OC1=C(C=C(C=C1)Cl)/C=N/OCC#C
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Product OPENEYE NAME: [4-chloro-2-[(E)-methoxyiminomethyl]phenyl] acetate
CAS Name: acetic acid [4-chloro-2-[(E)-methoxyiminomethyl]phenyl] ester
IUPAC NAME: [4-chloro-2-[(E)-methoxyiminomethyl]phenyl] acetate
SYSTEMATIC NAME: [4-chloranyl-2-[(E)-methoxyiminomethyl]phenyl] ethanoate
MOLECULAR FORMULA: C10H10ClNO3
MOLECULAR WEIGHT: 227.6443
SMILES: CC(=O)OC1=C(C=C(C=C1)Cl)/C=N/OC
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Product OPENEYE NAME: [4-chloro-2-[(E)-prop-2-ynoxyiminomethyl]phenyl] 2,2-dimethylpropanoate
CAS Name: 2,2-dimethylpropanoic acid [4-chloro-2-[(E)-prop-2-ynoxyiminomethyl]phenyl] ester
IUPAC NAME: [4-chloro-2-[(E)-prop-2-ynoxyiminomethyl]phenyl] 2,2-dimethylpropanoate
SYSTEMATIC NAME: [4-chloranyl-2-[(E)-prop-2-ynoxyiminomethyl]phenyl] 2,2-dimethylpropanoate
MOLECULAR FORMULA: C15H16ClNO3
MOLECULAR WEIGHT: 293.74544
SMILES: CC(C)(C)C(=O)OC1=C(C=C(C=C1)Cl)/C=N/OCC#C
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Product OPENEYE NAME: [4-chloro-2-[(E)-prop-2-ynoxyiminomethyl]phenyl] 4-nitrobenzoate
CAS Name: 4-nitrobenzoic acid [4-chloro-2-[(E)-prop-2-ynoxyiminomethyl]phenyl] ester
IUPAC NAME: [4-chloro-2-[(E)-prop-2-ynoxyiminomethyl]phenyl] 4-nitrobenzoate
SYSTEMATIC NAME: [4-chloranyl-2-[(E)-prop-2-ynoxyiminomethyl]phenyl] 4-nitrobenzoate
MOLECULAR FORMULA: C17H11ClN2O5
MOLECULAR WEIGHT: 358.73264
SMILES: C#CCO/N=C/C1=C(C=CC(=C1)Cl)OC(=O)C2=CC=C(C=C2)[N+](=O)[O-]
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Product OPENEYE NAME: [4-chloro-2-[(E)-prop-2-ynoxyiminomethyl]phenyl] 4-methoxybenzoate
CAS Name: 4-methoxybenzoic acid [4-chloro-2-[(E)-prop-2-ynoxyiminomethyl]phenyl] ester
IUPAC NAME: [4-chloro-2-[(E)-prop-2-ynoxyiminomethyl]phenyl] 4-methoxybenzoate
SYSTEMATIC NAME: [4-chloranyl-2-[(E)-prop-2-ynoxyiminomethyl]phenyl] 4-methoxybenzoate
MOLECULAR FORMULA: C18H14ClNO4
MOLECULAR WEIGHT: 343.76106
SMILES: COC1=CC=C(C=C1)C(=O)OC2=C(C=C(C=C2)Cl)/C=N/OCC#C
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Product OPENEYE NAME: [4-chloro-2-[(E)-prop-2-ynoxyiminomethyl]phenyl] 2-chloroacetate
CAS Name: 2-chloroacetic acid [4-chloro-2-[(E)-prop-2-ynoxyiminomethyl]phenyl] ester
IUPAC NAME: [4-chloro-2-[(E)-prop-2-ynoxyiminomethyl]phenyl] 2-chloroacetate
SYSTEMATIC NAME: [4-chloranyl-2-[(E)-prop-2-ynoxyiminomethyl]phenyl] 2-chloranylethanoate
MOLECULAR FORMULA: C12H9Cl2NO3
MOLECULAR WEIGHT: 286.11076
SMILES: C#CCO/N=C/C1=C(C=CC(=C1)Cl)OC(=O)CCl
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Product OPENEYE NAME: [4-chloro-2-[(E)-prop-2-ynoxyiminomethyl]phenyl] 2,2,2-trichloroacetate
CAS Name: 2,2,2-trichloroacetic acid [4-chloro-2-[(E)-prop-2-ynoxyiminomethyl]phenyl] ester
IUPAC NAME: [4-chloro-2-[(E)-prop-2-ynoxyiminomethyl]phenyl] 2,2,2-trichloroacetate
SYSTEMATIC NAME: [4-chloranyl-2-[(E)-prop-2-ynoxyiminomethyl]phenyl] 2,2,2-tris(chloranyl)ethanoate
MOLECULAR FORMULA: C12H7Cl4NO3
MOLECULAR WEIGHT: 355.00088
SMILES: C#CCO/N=C/C1=C(C=CC(=C1)Cl)OC(=O)C(Cl)(Cl)Cl
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Product OPENEYE NAME: 1-[2-[tert-butyl(dimethyl)silyl]oxy-4-chloro-phenyl]-N-prop-2-ynoxy-methanimine
CAS Name: 1-[2-[tert-butyl(dimethyl)silyl]oxy-4-chlorophenyl]-N-prop-2-ynoxymethanimine
IUPAC NAME: 1-[2-[tert-butyl(dimethyl)silyl]oxy-4-chlorophenyl]-N-prop-2-ynoxymethanimine
SYSTEMATIC NAME: 1-[2-[tert-butyl(dimethyl)silyl]oxy-4-chloranyl-phenyl]-N-prop-2-ynoxy-methanimine
MOLECULAR FORMULA: C16H22ClNO2Si
MOLECULAR WEIGHT: 323.88988
SMILES: CC(C)(C)[Si](C)(C)OC1=C(C=CC(=C1)Cl)/C=N/OCC#C
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Product OPENEYE NAME: (6S,10bR)-6-phenyl-1,2,3,5,6,10b-hexahydropyrrolo[2,1-a]isoquinoline-8,9-diol
CAS Name: (6S,10bR)-6-phenyl-1,2,3,5,6,10b-hexahydropyrrolo[2,1-a]isoquinoline-8,9-diol
IUPAC NAME: (6S,10bR)-6-phenyl-1,2,3,5,6,10b-hexahydropyrrolo[2,1-a]isoquinoline-8,9-diol
SYSTEMATIC NAME: (6S,10bR)-6-phenyl-1,2,3,5,6,10b-hexahydropyrrolo[2,1-a]isoquinoline-8,9-diol
MOLECULAR FORMULA: C18H19NO2
MOLECULAR WEIGHT: 281.34896
SMILES: C1C[C@@H]2C3=CC(=C(C=C3[C@@H](CN2C1)C4=CC=CC=C4)O)O
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Product OPENEYE NAME: (6S,10bR)-6-(4-chlorophenyl)-1,2,3,5,6,10b-hexahydropyrrolo[2,1-a]isoquinoline
CAS Name: (6S,10bR)-6-(4-chlorophenyl)-1,2,3,5,6,10b-hexahydropyrrolo[2,1-a]isoquinoline
IUPAC NAME: (6S,10bR)-6-(4-chlorophenyl)-1,2,3,5,6,10b-hexahydropyrrolo[2,1-a]isoquinoline
SYSTEMATIC NAME: (6S,10bR)-6-(4-chlorophenyl)-1,2,3,5,6,10b-hexahydropyrrolo[2,1-a]isoquinoline
MOLECULAR FORMULA: C18H18ClN
MOLECULAR WEIGHT: 283.79522
SMILES: C1C[C@@H]2C3=CC=CC=C3[C@@H](CN2C1)C4=CC=C(C=C4)Cl
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Product OPENEYE NAME: (6S,10bS)-6-(4-chlorophenyl)-1,2,3,5,6,10b-hexahydropyrrolo[2,1-a]isoquinoline
CAS Name: (6S,10bS)-6-(4-chlorophenyl)-1,2,3,5,6,10b-hexahydropyrrolo[2,1-a]isoquinoline
IUPAC NAME: (6S,10bS)-6-(4-chlorophenyl)-1,2,3,5,6,10b-hexahydropyrrolo[2,1-a]isoquinoline
SYSTEMATIC NAME: (6S,10bS)-6-(4-chlorophenyl)-1,2,3,5,6,10b-hexahydropyrrolo[2,1-a]isoquinoline
MOLECULAR FORMULA: C18H18ClN
MOLECULAR WEIGHT: 283.79522
SMILES: C1C[C@H]2C3=CC=CC=C3[C@@H](CN2C1)C4=CC=C(C=C4)Cl
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