Friday, April 27, 2012

All Chemical Compounds Information




Product OPENEYE NAME: [(1S)-1-methyl-2-(4-methyl-1-piperidyl)ethyl] 2,3-dihydro-1,4-benzodioxine-6-carboxylate
CAS Name: 2,3-dihydro-1,4-benzodioxin-6-carboxylic acid [(2S)-1-(4-methyl-1-piperidinyl)propan-2-yl] ester
IUPAC NAME: [(2S)-1-(4-methylpiperidin-1-yl)propan-2-yl] 2,3-dihydro-1,4-benzodioxine-6-carboxylate
SYSTEMATIC NAME: [(2S)-1-(4-methylpiperidin-1-yl)propan-2-yl] 2,3-dihydro-1,4-benzodioxine-6-carboxylate
MOLECULAR FORMULA: C18H25NO4
MOLECULAR WEIGHT: 319.3954
SMILES: CC1CCN(CC1)C[C@H](C)OC(=O)C2=CC3=C(C=C2)OCCO3
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Product OPENEYE NAME: [(1R)-1-methyl-2-(4-methyl-1-piperidyl)ethyl] (3R)-2,3-dihydro-1,4-benzodioxine-3-carboxylate
CAS Name: (3R)-2,3-dihydro-1,4-benzodioxin-3-carboxylic acid [(2R)-1-(4-methyl-1-piperidinyl)propan-2-yl] ester
IUPAC NAME: [(2R)-1-(4-methylpiperidin-1-yl)propan-2-yl] (3R)-2,3-dihydro-1,4-benzodioxine-3-carboxylate
SYSTEMATIC NAME: [(2R)-1-(4-methylpiperidin-1-yl)propan-2-yl] (3R)-2,3-dihydro-1,4-benzodioxine-3-carboxylate
MOLECULAR FORMULA: C18H25NO4
MOLECULAR WEIGHT: 319.3954
SMILES: CC1CCN(CC1)C[C@@H](C)OC(=O)[C@H]2COC3=CC=CC=C3O2
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Product OPENEYE NAME: [(1S)-1-methyl-2-(4-methyl-1-piperidyl)ethyl] (3R)-2,3-dihydro-1,4-benzodioxine-3-carboxylate
CAS Name: (3R)-2,3-dihydro-1,4-benzodioxin-3-carboxylic acid [(2S)-1-(4-methyl-1-piperidinyl)propan-2-yl] ester
IUPAC NAME: [(2S)-1-(4-methylpiperidin-1-yl)propan-2-yl] (3R)-2,3-dihydro-1,4-benzodioxine-3-carboxylate
SYSTEMATIC NAME: [(2S)-1-(4-methylpiperidin-1-yl)propan-2-yl] (3R)-2,3-dihydro-1,4-benzodioxine-3-carboxylate
MOLECULAR FORMULA: C18H25NO4
MOLECULAR WEIGHT: 319.3954
SMILES: CC1CCN(CC1)C[C@H](C)OC(=O)[C@H]2COC3=CC=CC=C3O2
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Product OPENEYE NAME: [(1R)-1-methyl-2-(4-methyl-1-piperidyl)ethyl] (3S)-2,3-dihydro-1,4-benzodioxine-3-carboxylate
CAS Name: (3S)-2,3-dihydro-1,4-benzodioxin-3-carboxylic acid [(2R)-1-(4-methyl-1-piperidinyl)propan-2-yl] ester
IUPAC NAME: [(2R)-1-(4-methylpiperidin-1-yl)propan-2-yl] (3S)-2,3-dihydro-1,4-benzodioxine-3-carboxylate
SYSTEMATIC NAME: [(2R)-1-(4-methylpiperidin-1-yl)propan-2-yl] (3S)-2,3-dihydro-1,4-benzodioxine-3-carboxylate
MOLECULAR FORMULA: C18H25NO4
MOLECULAR WEIGHT: 319.3954
SMILES: CC1CCN(CC1)C[C@@H](C)OC(=O)[C@@H]2COC3=CC=CC=C3O2
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Product OPENEYE NAME: [(1S)-1-methyl-2-(4-methyl-1-piperidyl)ethyl] (3S)-2,3-dihydro-1,4-benzodioxine-3-carboxylate
CAS Name: (3S)-2,3-dihydro-1,4-benzodioxin-3-carboxylic acid [(2S)-1-(4-methyl-1-piperidinyl)propan-2-yl] ester
IUPAC NAME: [(2S)-1-(4-methylpiperidin-1-yl)propan-2-yl] (3S)-2,3-dihydro-1,4-benzodioxine-3-carboxylate
SYSTEMATIC NAME: [(2S)-1-(4-methylpiperidin-1-yl)propan-2-yl] (3S)-2,3-dihydro-1,4-benzodioxine-3-carboxylate
MOLECULAR FORMULA: C18H25NO4
MOLECULAR WEIGHT: 319.3954
SMILES: CC1CCN(CC1)C[C@H](C)OC(=O)[C@@H]2COC3=CC=CC=C3O2
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Product OPENEYE NAME: 1-[2-(2-methoxyphenoxy)ethyl]pyrrole-2-carbaldehyde
CAS Name: 1-[2-(2-methoxyphenoxy)ethyl]-2-pyrrolecarboxaldehyde
IUPAC NAME: 1-[2-(2-methoxyphenoxy)ethyl]pyrrole-2-carbaldehyde
SYSTEMATIC NAME: 1-[2-(2-methoxyphenoxy)ethyl]pyrrole-2-carbaldehyde
MOLECULAR FORMULA: C14H15NO3
MOLECULAR WEIGHT: 245.2738
SMILES: COC1=CC=CC=C1OCCN2C=CC=C2C=O
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Product OPENEYE NAME: 1-[2-(4-chlorophenoxy)ethyl]pyrrole-2-carbaldehyde
CAS Name: 1-[2-(4-chlorophenoxy)ethyl]-2-pyrrolecarboxaldehyde
IUPAC NAME: 1-[2-(4-chlorophenoxy)ethyl]pyrrole-2-carbaldehyde
SYSTEMATIC NAME: 1-[2-(4-chloranylphenoxy)ethyl]pyrrole-2-carbaldehyde
MOLECULAR FORMULA: C13H12ClNO2
MOLECULAR WEIGHT: 249.69288
SMILES: C1=CN(C(=C1)C=O)CCOC2=CC=C(C=C2)Cl
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Product OPENEYE NAME: 1-[(2-fluorophenyl)methyl]pyrrole-2-carbaldehyde
CAS Name: 1-[(2-fluorophenyl)methyl]-2-pyrrolecarboxaldehyde
IUPAC NAME: 1-[(2-fluorophenyl)methyl]pyrrole-2-carbaldehyde
SYSTEMATIC NAME: 1-[(2-fluorophenyl)methyl]pyrrole-2-carbaldehyde
MOLECULAR FORMULA: C12H10FNO
MOLECULAR WEIGHT: 203.212303
SMILES: C1=CC=C(C(=C1)CN2C=CC=C2C=O)F
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Product OPENEYE NAME: 5-[(4-methoxyphenoxy)methyl]-1,3,4-thiadiazol-2-amine
CAS Name: 5-[(4-methoxyphenoxy)methyl]-1,3,4-thiadiazol-2-amine
IUPAC NAME: 5-[(4-methoxyphenoxy)methyl]-1,3,4-thiadiazol-2-amine
SYSTEMATIC NAME: 5-[(4-methoxyphenoxy)methyl]-1,3,4-thiadiazol-2-amine
MOLECULAR FORMULA: C10H11N3O2S
MOLECULAR WEIGHT: 237.27824
SMILES: COC1=CC=C(C=C1)OCC2=NN=C(S2)N
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Product OPENEYE NAME: 5-[2-(2-methoxyphenoxy)ethyl]-1,3,4-thiadiazol-2-amine
CAS Name: 5-[2-(2-methoxyphenoxy)ethyl]-1,3,4-thiadiazol-2-amine
IUPAC NAME: 5-[2-(2-methoxyphenoxy)ethyl]-1,3,4-thiadiazol-2-amine
SYSTEMATIC NAME: 5-[2-(2-methoxyphenoxy)ethyl]-1,3,4-thiadiazol-2-amine
MOLECULAR FORMULA: C11H13N3O2S
MOLECULAR WEIGHT: 251.30482
SMILES: COC1=CC=CC=C1OCCC2=NN=C(S2)N
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Product OPENEYE NAME: 5-[2-(4-methoxyphenoxy)ethyl]-1,3,4-thiadiazol-2-amine
CAS Name: 5-[2-(4-methoxyphenoxy)ethyl]-1,3,4-thiadiazol-2-amine
IUPAC NAME: 5-[2-(4-methoxyphenoxy)ethyl]-1,3,4-thiadiazol-2-amine
SYSTEMATIC NAME: 5-[2-(4-methoxyphenoxy)ethyl]-1,3,4-thiadiazol-2-amine
MOLECULAR FORMULA: C11H13N3O2S
MOLECULAR WEIGHT: 251.30482
SMILES: COC1=CC=C(C=C1)OCCC2=NN=C(S2)N
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Product OPENEYE NAME: 5-[2-(2-chlorophenoxy)ethyl]-1,3,4-thiadiazol-2-amine
CAS Name: 5-[2-(2-chlorophenoxy)ethyl]-1,3,4-thiadiazol-2-amine
IUPAC NAME: 5-[2-(2-chlorophenoxy)ethyl]-1,3,4-thiadiazol-2-amine
SYSTEMATIC NAME: 5-[2-(2-chloranylphenoxy)ethyl]-1,3,4-thiadiazol-2-amine
MOLECULAR FORMULA: C10H10ClN3OS
MOLECULAR WEIGHT: 255.7239
SMILES: C1=CC=C(C(=C1)OCCC2=NN=C(S2)N)Cl
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Product OPENEYE NAME: 5-[2-(4-chlorophenoxy)ethyl]-1,3,4-thiadiazol-2-amine
CAS Name: 5-[2-(4-chlorophenoxy)ethyl]-1,3,4-thiadiazol-2-amine
IUPAC NAME: 5-[2-(4-chlorophenoxy)ethyl]-1,3,4-thiadiazol-2-amine
SYSTEMATIC NAME: 5-[2-(4-chloranylphenoxy)ethyl]-1,3,4-thiadiazol-2-amine
MOLECULAR FORMULA: C10H10ClN3OS
MOLECULAR WEIGHT: 255.7239
SMILES: C1=CC(=CC=C1OCCC2=NN=C(S2)N)Cl
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Product OPENEYE NAME: 5-[(1S)-1-(4-methoxyphenoxy)ethyl]-1,3,4-thiadiazol-2-amine
CAS Name: 5-[(1S)-1-(4-methoxyphenoxy)ethyl]-1,3,4-thiadiazol-2-amine
IUPAC NAME: 5-[(1S)-1-(4-methoxyphenoxy)ethyl]-1,3,4-thiadiazol-2-amine
SYSTEMATIC NAME: 5-[(1S)-1-(4-methoxyphenoxy)ethyl]-1,3,4-thiadiazol-2-amine
MOLECULAR FORMULA: C11H13N3O2S
MOLECULAR WEIGHT: 251.30482
SMILES: C[C@@H](C1=NN=C(S1)N)OC2=CC=C(C=C2)OC
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Product OPENEYE NAME: 5-[(1R)-1-(4-methoxyphenoxy)ethyl]-1,3,4-thiadiazol-2-amine
CAS Name: 5-[(1R)-1-(4-methoxyphenoxy)ethyl]-1,3,4-thiadiazol-2-amine
IUPAC NAME: 5-[(1R)-1-(4-methoxyphenoxy)ethyl]-1,3,4-thiadiazol-2-amine
SYSTEMATIC NAME: 5-[(1R)-1-(4-methoxyphenoxy)ethyl]-1,3,4-thiadiazol-2-amine
MOLECULAR FORMULA: C11H13N3O2S
MOLECULAR WEIGHT: 251.30482
SMILES: C[C@H](C1=NN=C(S1)N)OC2=CC=C(C=C2)OC
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Product OPENEYE NAME: 5-[(1S)-1-(2-chlorophenoxy)ethyl]-1,3,4-thiadiazol-2-amine
CAS Name: 5-[(1S)-1-(2-chlorophenoxy)ethyl]-1,3,4-thiadiazol-2-amine
IUPAC NAME: 5-[(1S)-1-(2-chlorophenoxy)ethyl]-1,3,4-thiadiazol-2-amine
SYSTEMATIC NAME: 5-[(1S)-1-(2-chloranylphenoxy)ethyl]-1,3,4-thiadiazol-2-amine
MOLECULAR FORMULA: C10H10ClN3OS
MOLECULAR WEIGHT: 255.7239
SMILES: C[C@@H](C1=NN=C(S1)N)OC2=CC=CC=C2Cl
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