Monday, June 27, 2011

http://ChemLookup.com Compounds




CAS RN: 1223748-51-3
CAS Name: 2-(2-cyanophenyl)ethanesulfonic acid
OPENEYE Name: 2-(2-cyanophenyl)ethanesulfonic acid
IUPAC Name: 2-(2-cyanophenyl)ethanesulfonic acid
SYSTEMATIC NAME: 2-(2-cyanophenyl)ethanesulfonic acid
MOLECULAR FORMULA: C9H9NO3S
MOLECULAR WEIGHT: 211.23766
SMILES: C1=CC=C(C(=C1)CCS(=O)(=O)O)C#N

CAS RN: 756469-30-4
CAS Name: 2-(4-methoxycarbonylphenyl)ethanesulfonic acid
OPENEYE Name: 2-(4-methoxycarbonylphenyl)ethanesulfonic acid
IUPAC Name: 2-(4-methoxycarbonylphenyl)ethanesulfonic acid
SYSTEMATIC NAME: 2-(4-methoxycarbonylphenyl)ethanesulfonic acid
MOLECULAR FORMULA: C10H12O5S
MOLECULAR WEIGHT: 244.26428
SMILES: COC(=O)C1=CC=C(C=C1)CCS(=O)(=O)O

CAS RN: 1223748-39-7
CAS Name: 3-(4-methoxycarbonylphenyl)-1-propanesulfonic acid
OPENEYE Name: 3-(4-methoxycarbonylphenyl)propane-1-sulfonic acid
IUPAC Name: 3-(4-methoxycarbonylphenyl)propane-1-sulfonic acid
SYSTEMATIC NAME: 3-(4-methoxycarbonylphenyl)propane-1-sulfonic acid
MOLECULAR FORMULA: C11H14O5S
MOLECULAR WEIGHT: 258.29086
SMILES: COC(=O)C1=CC=C(C=C1)CCCS(=O)(=O)O

CAS RN: 791642-68-7
CAS Name: 4-bromo-1-iodo-2-methoxybenzene
OPENEYE Name: 4-bromo-1-iodo-2-methoxy-benzene
IUPAC Name: 4-bromo-1-iodo-2-methoxybenzene
SYSTEMATIC NAME: 4-bromanyl-1-iodanyl-2-methoxy-benzene
MOLECULAR FORMULA: C7H6BrIO
MOLECULAR WEIGHT: 312.93041
SMILES: COC1=C(C=CC(=C1)Br)I

CAS RN: 1223748-25-1
CAS Name: 2-propenoic acid (3,5-ditert-butylphenyl) ester
OPENEYE Name: (3,5-ditert-butylphenyl) prop-2-enoate
IUPAC Name: (3,5-ditert-butylphenyl) prop-2-enoate
SYSTEMATIC NAME: (3,5-ditert-butylphenyl) prop-2-enoate
MOLECULAR FORMULA: C17H24O2
MOLECULAR WEIGHT: 260.37126
SMILES: CC(C)(C)C1=CC(=CC(=C1)OC(=O)C=C)C(C)(C)C

CAS RN: 911099-61-1
CAS Name: 1-(aminomethyl)-3,3-dimethyl-1-cyclohexanol
OPENEYE Name: 1-(aminomethyl)-3,3-dimethyl-cyclohexanol
IUPAC Name: 1-(aminomethyl)-3,3-dimethylcyclohexan-1-ol
SYSTEMATIC NAME: 1-(aminomethyl)-3,3-dimethyl-cyclohexan-1-ol
MOLECULAR FORMULA: C9H19NO
MOLECULAR WEIGHT: 157.25326
SMILES: CC1(CCCC(C1)(CN)O)C

CAS RN: 874473-14-0
CAS Name: 3-methyl-3-oxetanamine
OPENEYE Name: 3-methyloxetan-3-amine
IUPAC Name: 3-methyloxetan-3-amine
SYSTEMATIC NAME: 3-methyloxetan-3-amine
MOLECULAR FORMULA: C4H9NO
MOLECULAR WEIGHT: 87.12036
SMILES: CC1(COC1)N

CAS RN: 1190319-59-5
CAS Name: 1H-pyrrolo[2,3-c]pyridine-4-carbonitrile
OPENEYE Name: 1H-pyrrolo[2,3-c]pyridine-4-carbonitrile
IUPAC Name: 1H-pyrrolo[2,3-c]pyridine-4-carbonitrile
SYSTEMATIC NAME: 1H-pyrrolo[2,3-c]pyridine-4-carbonitrile
MOLECULAR FORMULA: C8H5N3
MOLECULAR WEIGHT: 143.1454
SMILES: C1=CNC2=C1C(=CN=C2)C#N

CAS RN: 1223748-24-0
CAS Name: 5-chloro-1-(2-trimethylsilylethoxymethyl)-2-pyrrolo[2,3-c]pyridinecarboxylic acid
OPENEYE Name: 5-chloro-1-(2-trimethylsilylethoxymethyl)pyrrolo[2,3-c]pyridine-2-carboxylic acid
IUPAC Name: 5-chloro-1-(2-trimethylsilylethoxymethyl)pyrrolo[2,3-c]pyridine-2-carboxylic acid
SYSTEMATIC NAME: 5-chloranyl-1-(2-trimethylsilylethoxymethyl)pyrrolo[2,3-c]pyridine-2-carboxylic acid
MOLECULAR FORMULA: C14H19ClN2O3Si
MOLECULAR WEIGHT: 326.85076
SMILES: C[Si](C)(C)CCOCN1C(=CC2=CC(=NC=C21)Cl)C(=O)O

CAS RN: 800401-71-2
CAS Name: 5-bromo-1H-pyrrolo[2,3-c]pyridine-2-carboxylic acid
OPENEYE Name: 5-bromo-1H-pyrrolo[2,3-c]pyridine-2-carboxylic acid
IUPAC Name: 5-bromo-1H-pyrrolo[2,3-c]pyridine-2-carboxylic acid
SYSTEMATIC NAME: 5-bromanyl-1H-pyrrolo[2,3-c]pyridine-2-carboxylic acid
MOLECULAR FORMULA: C8H5BrN2O2
MOLECULAR WEIGHT: 241.0415
SMILES: C1=C2C=C(NC2=CN=C1Br)C(=O)O

CAS RN: 253787-45-0
CAS Name: 8-bromo-5-quinolinecarboxylic acid methyl ester
OPENEYE Name: methyl 8-bromoquinoline-5-carboxylate
IUPAC Name: methyl 8-bromoquinoline-5-carboxylate
SYSTEMATIC NAME: methyl 8-bromanylquinoline-5-carboxylate
MOLECULAR FORMULA: C11H8BrNO2
MOLECULAR WEIGHT: 266.09072
SMILES: COC(=O)C1=C2C=CC=NC2=C(C=C1)Br

CAS RN: 1190315-99-1
CAS Name: (8-bromo-4-quinolinyl)methanol
OPENEYE Name: (8-bromo-4-quinolyl)methanol
IUPAC Name: (8-bromoquinolin-4-yl)methanol
SYSTEMATIC NAME: (8-bromanylquinolin-4-yl)methanol
MOLECULAR FORMULA: C10H8BrNO
MOLECULAR WEIGHT: 238.08062
SMILES: C1=CC2=C(C=CN=C2C(=C1)Br)CO

CAS RN: 898391-87-2
CAS Name: 8-bromo-4-quinolinecarboxaldehyde
OPENEYE Name: 8-bromoquinoline-4-carbaldehyde
IUPAC Name: 8-bromoquinoline-4-carbaldehyde
SYSTEMATIC NAME: 8-bromanylquinoline-4-carbaldehyde
MOLECULAR FORMULA: C10H6BrNO
MOLECULAR WEIGHT: 236.06474
SMILES: C1=CC2=C(C=CN=C2C(=C1)Br)C=O

CAS RN: 1190315-89-9
CAS Name: 8-bromo-4-quinolinecarbonitrile
OPENEYE Name: 8-bromoquinoline-4-carbonitrile
IUPAC Name: 8-bromoquinoline-4-carbonitrile
SYSTEMATIC NAME: 8-bromanylquinoline-4-carbonitrile
MOLECULAR FORMULA: C10H5BrN2
MOLECULAR WEIGHT: 233.0641
SMILES: C1=CC2=C(C=CN=C2C(=C1)Br)C#N

CAS RN: 1190322-58-7
CAS Name: 1-(8-bromo-4-quinolinyl)-N-methylmethanamine
OPENEYE Name: 1-(8-bromo-4-quinolyl)-N-methyl-methanamine
IUPAC Name: 1-(8-bromoquinolin-4-yl)-N-methylmethanamine
SYSTEMATIC NAME: 1-(8-bromanylquinolin-4-yl)-N-methyl-methanamine
MOLECULAR FORMULA: C11H11BrN2
MOLECULAR WEIGHT: 251.12244
SMILES: CNCC1=C2C=CC=C(C2=NC=C1)Br

CAS RN: 1093879-46-9
CAS Name: 2-(6-bromo-2-pyridinyl)acetic acid
OPENEYE Name: 2-(6-bromo-2-pyridyl)acetic acid
IUPAC Name: 2-(6-bromopyridin-2-yl)acetic acid
SYSTEMATIC NAME: 2-(6-bromanylpyridin-2-yl)ethanoic acid
MOLECULAR FORMULA: C7H6BrNO2
MOLECULAR WEIGHT: 216.03204
SMILES: C1=CC(=NC(=C1)Br)CC(=O)O

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