Sunday, June 26, 2011

http://ChemLookup.com Compounds




CAS RN: 1223748-41-1
CAS Name: 4-[2-(2-bromoethoxy)phenyl]-1,2,4-triazole
OPENEYE Name: 4-[2-(2-bromoethoxy)phenyl]-1,2,4-triazole
IUPAC Name: 4-[2-(2-bromoethoxy)phenyl]-1,2,4-triazole
SYSTEMATIC NAME: 4-[2-(2-bromoethyloxy)phenyl]-1,2,4-triazole
MOLECULAR FORMULA: C10H10BrN3O
MOLECULAR WEIGHT: 268.1099
SMILES: C1=CC=C(C(=C1)N2C=NN=C2)OCCBr

CAS RN: 1223748-48-8
CAS Name: 4-[4-(2-bromoethoxy)phenyl]-1,2,4-triazole
OPENEYE Name: 4-[4-(2-bromoethoxy)phenyl]-1,2,4-triazole
IUPAC Name: 4-[4-(2-bromoethoxy)phenyl]-1,2,4-triazole
SYSTEMATIC NAME: 4-[4-(2-bromoethyloxy)phenyl]-1,2,4-triazole
MOLECULAR FORMULA: C10H10BrN3O
MOLECULAR WEIGHT: 268.1099
SMILES: C1=CC(=CC=C1N2C=NN=C2)OCCBr

CAS RN: 895573-64-5
CAS Name: 5-methyl-3-(3-piperidinyl)-1,2,4-oxadiazole
OPENEYE Name: 5-methyl-3-(3-piperidyl)-1,2,4-oxadiazole
IUPAC Name: 5-methyl-3-piperidin-3-yl-1,2,4-oxadiazole
SYSTEMATIC NAME: 5-methyl-3-piperidin-3-yl-1,2,4-oxadiazole
MOLECULAR FORMULA: C8H13N3O
MOLECULAR WEIGHT: 167.20832
SMILES: CC1=NC(=NO1)C2CCCNC2

CAS RN: 1223748-40-0
CAS Name: N,N-dimethyl-4-(3-pyrrolidinyl)benzamide hydrochloride
OPENEYE Name: N,N-dimethyl-4-pyrrolidin-3-yl-benzamide hydrochloride
IUPAC Name: N,N-dimethyl-4-pyrrolidin-3-ylbenzamide hydrochloride
SYSTEMATIC NAME: N,N-dimethyl-4-pyrrolidin-3-yl-benzamide hydrochloride
MOLECULAR FORMULA: C13H19ClN2O
MOLECULAR WEIGHT: 254.75576
SMILES: CN(C)C(=O)C1=CC=C(C=C1)C2CCNC2.Cl

CAS RN: 1223748-27-3
CAS Name: N-ethyl-N-methyl-3-(3-pyrrolidinyl)benzamide hydrochloride
OPENEYE Name: N-ethyl-N-methyl-3-pyrrolidin-3-yl-benzamide hydrochloride
IUPAC Name: N-ethyl-N-methyl-3-pyrrolidin-3-ylbenzamide hydrochloride
SYSTEMATIC NAME: N-ethyl-N-methyl-3-pyrrolidin-3-yl-benzamide hydrochloride
MOLECULAR FORMULA: C14H21ClN2O
MOLECULAR WEIGHT: 268.78234
SMILES: CCN(C)C(=O)C1=CC(=CC=C1)C2CCNC2.Cl

CAS RN: 815632-23-6
CAS Name: 5-(4-methylphenyl)-2,3,3a,4,6,6a-hexahydro-1H-pyrrolo[3,4-c]pyrrole
OPENEYE Name: 5-(p-tolyl)-2,3,3a,4,6,6a-hexahydro-1H-pyrrolo[3,4-c]pyrrole
IUPAC Name: 5-(4-methylphenyl)-2,3,3a,4,6,6a-hexahydro-1H-pyrrolo[3,4-c]pyrrole
SYSTEMATIC NAME: 5-(4-methylphenyl)-2,3,3a,4,6,6a-hexahydro-1H-pyrrolo[3,4-c]pyrrole
MOLECULAR FORMULA: C13H18N2
MOLECULAR WEIGHT: 202.29542
SMILES: CC1=CC=C(C=C1)N2CC3CNCC3C2

CAS RN: 1223748-49-9
CAS Name: 5-chloro-4-(chloromethyl)-2-thiophenecarboxylic acid
OPENEYE Name: 5-chloro-4-(chloromethyl)thiophene-2-carboxylic acid
IUPAC Name: 5-chloro-4-(chloromethyl)thiophene-2-carboxylic acid
SYSTEMATIC NAME: 5-chloranyl-4-(chloromethyl)thiophene-2-carboxylic acid
MOLECULAR FORMULA: C6H4Cl2O2S
MOLECULAR WEIGHT: 211.06576
SMILES: C1=C(SC(=C1CCl)Cl)C(=O)O

CAS RN: 1056619-14-7
CAS Name: 2-(5-nitro-1-indazolyl)ethanol
OPENEYE Name: 2-(5-nitroindazol-1-yl)ethanol
IUPAC Name: 2-(5-nitroindazol-1-yl)ethanol
SYSTEMATIC NAME: 2-(5-nitroindazol-1-yl)ethanol
MOLECULAR FORMULA: C9H9N3O3
MOLECULAR WEIGHT: 207.18606
SMILES: C1=CC2=C(C=C1[N+](=O)[O-])C=NN2CCO

CAS RN: 1223748-52-4
CAS Name: 3-(7-cyano-1H-indol-3-yl)propanoic acid
OPENEYE Name: 3-(7-cyano-1H-indol-3-yl)propanoic acid
IUPAC Name: 3-(7-cyano-1H-indol-3-yl)propanoic acid
SYSTEMATIC NAME: 3-(7-cyano-1H-indol-3-yl)propanoic acid
MOLECULAR FORMULA: C12H10N2O2
MOLECULAR WEIGHT: 214.22
SMILES: C1=CC(=C2C(=C1)C(=CN2)CCC(=O)O)C#N

CAS RN: 146984-79-4
CAS Name: 3-chloro-6-hydroxy-2-methoxybenzoic acid
OPENEYE Name: 3-chloro-6-hydroxy-2-methoxy-benzoic acid
IUPAC Name: 3-chloro-6-hydroxy-2-methoxybenzoic acid
SYSTEMATIC NAME: 3-chloranyl-2-methoxy-6-oxidanyl-benzoic acid
MOLECULAR FORMULA: C8H7ClO4
MOLECULAR WEIGHT: 202.59178
SMILES: COC1=C(C=CC(=C1C(=O)O)O)Cl

CAS RN: 558453-64-8
CAS Name: (6-chloro-3a,7a-dihydro-1,3-benzodioxol-5-yl)methanamine
OPENEYE Name: (6-chloro-3a,7a-dihydro-1,3-benzodioxol-5-yl)methanamine
IUPAC Name: (6-chloro-3a,7a-dihydro-1,3-benzodioxol-5-yl)methanamine
SYSTEMATIC NAME: (6-chloranyl-3a,7a-dihydro-1,3-benzodioxol-5-yl)methanamine
MOLECULAR FORMULA: C8H10ClNO2
MOLECULAR WEIGHT: 187.6235
SMILES: C1OC2C=C(C(=CC2O1)Cl)CN

CAS RN: 42247-74-5
CAS Name: 2-(2-hydroxyethyl)benzonitrile
OPENEYE Name: 2-(2-hydroxyethyl)benzonitrile
IUPAC Name: 2-(2-hydroxyethyl)benzonitrile
SYSTEMATIC NAME: 2-(2-hydroxyethyl)benzenecarbonitrile
MOLECULAR FORMULA: C9H9NO
MOLECULAR WEIGHT: 147.17386
SMILES: C1=CC=C(C(=C1)CCO)C#N

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