Monday, June 27, 2011

http://ChemLookup.com Compounds




CAS RN: 774163-31-4
CAS Name: 7-fluoro-3,4-dihydro-2H-1-benzopyran-4-amine
OPENEYE Name: 7-fluorochroman-4-amine
IUPAC Name: 7-fluoro-3,4-dihydro-2H-chromen-4-amine
SYSTEMATIC NAME: 7-fluoranyl-3,4-dihydro-2H-chromen-4-amine
MOLECULAR FORMULA: C9H10FNO
MOLECULAR WEIGHT: 167.180203
SMILES: C1COC2=C(C1N)C=CC(=C2)F

CAS RN: 1018978-91-0
CAS Name: 7-fluoro-3,4-dihydro-2H-1-benzopyran-4-amine
OPENEYE Name: 7-fluorochroman-4-amine
IUPAC Name: 7-fluoro-3,4-dihydro-2H-chromen-4-amine
SYSTEMATIC NAME: 7-fluoranyl-3,4-dihydro-2H-chromen-4-amine
MOLECULAR FORMULA: C9H10FNO
MOLECULAR WEIGHT: 167.180203
SMILES: C1COC2=C(C1N)C=CC(=C2)F

CAS RN: 93608-00-5
CAS Name: 5-chloro-1-(phenylmethyl)tetrazole
OPENEYE Name: 1-benzyl-5-chloro-tetrazole
IUPAC Name: 1-benzyl-5-chlorotetrazole
SYSTEMATIC NAME: 5-chloranyl-1-(phenylmethyl)-1,2,3,4-tetrazole
MOLECULAR FORMULA: C8H7ClN4
MOLECULAR WEIGHT: 194.62098
SMILES: C1=CC=C(C=C1)CN2C(=NN=N2)Cl

CAS RN: 143394-93-8
CAS Name: 3-aminooxolane-2,5-dione hydrochloride
OPENEYE Name: 3-aminotetrahydrofuran-2,5-dione hydrochloride
IUPAC Name: 3-aminooxolane-2,5-dione hydrochloride
SYSTEMATIC NAME: 3-azanyloxolane-2,5-dione hydrochloride
MOLECULAR FORMULA: C4H6ClNO3
MOLECULAR WEIGHT: 151.54834
SMILES: C1C(C(=O)OC1=O)N.Cl

CAS RN: 917021-59-1
CAS Name: N-cyclohexyl-N-(4-oxobutyl)carbamic acid tert-butyl ester
OPENEYE Name: tert-butyl N-cyclohexyl-N-(4-oxobutyl)carbamate
IUPAC Name: tert-butyl N-cyclohexyl-N-(4-oxobutyl)carbamate
SYSTEMATIC NAME: tert-butyl N-cyclohexyl-N-(4-oxidanylidenebutyl)carbamate
MOLECULAR FORMULA: C15H27NO3
MOLECULAR WEIGHT: 269.37978
SMILES: CC(C)(C)OC(=O)N(CCCC=O)C1CCCCC1

CAS RN: 936497-77-7
CAS Name: N-[(hydroxyamino)methylidene]-2-phenylmethoxybenzamide
OPENEYE Name: 2-benzyloxy-N-[(hydroxyamino)methylene]benzamide
IUPAC Name: N-[(hydroxyamino)methylidene]-2-phenylmethoxybenzamide
SYSTEMATIC NAME: N-[(oxidanylamino)methylidene]-2-phenylmethoxy-benzamide
MOLECULAR FORMULA: C15H14N2O3
MOLECULAR WEIGHT: 270.28326
SMILES: C1=CC=C(C=C1)COC2=CC=CC=C2C(=O)N=CNO

CAS RN: 166168-16-7
CAS Name: 2-amino-2-[4-(aminomethyl)cyclohexyl]acetic acid tert-butyl ester
OPENEYE Name: tert-butyl 2-amino-2-[4-(aminomethyl)cyclohexyl]acetate
IUPAC Name: tert-butyl 2-amino-2-[4-(aminomethyl)cyclohexyl]acetate
SYSTEMATIC NAME: tert-butyl 2-[4-(aminomethyl)cyclohexyl]-2-azanyl-ethanoate
MOLECULAR FORMULA: C13H26N2O2
MOLECULAR WEIGHT: 242.35774
SMILES: CC(C)(C)OC(=O)C(C1CCC(CC1)CN)N

CAS RN: 886363-28-6
CAS Name: 2-[4-(1-indolyl)phenyl]acetic acid
OPENEYE Name: 2-(4-indol-1-ylphenyl)acetic acid
IUPAC Name: 2-(4-indol-1-ylphenyl)acetic acid
SYSTEMATIC NAME: 2-(4-indol-1-ylphenyl)ethanoic acid
MOLECULAR FORMULA: C16H13NO2
MOLECULAR WEIGHT: 251.27992
SMILES: C1=CC=C2C(=C1)C=CN2C3=CC=C(C=C3)CC(=O)O

CAS RN: 886363-20-8
CAS Name: 2-[3-(1-indolyl)phenyl]acetic acid
OPENEYE Name: 2-(3-indol-1-ylphenyl)acetic acid
IUPAC Name: 2-(3-indol-1-ylphenyl)acetic acid
SYSTEMATIC NAME: 2-(3-indol-1-ylphenyl)ethanoic acid
MOLECULAR FORMULA: C16H13NO2
MOLECULAR WEIGHT: 251.27992
SMILES: C1=CC=C2C(=C1)C=CN2C3=CC=CC(=C3)CC(=O)O

CAS RN: 886363-19-5
CAS Name: 2-[2-(1-indolyl)phenyl]acetic acid
OPENEYE Name: 2-(2-indol-1-ylphenyl)acetic acid
IUPAC Name: 2-(2-indol-1-ylphenyl)acetic acid
SYSTEMATIC NAME: 2-(2-indol-1-ylphenyl)ethanoic acid
MOLECULAR FORMULA: C16H13NO2
MOLECULAR WEIGHT: 251.27992
SMILES: C1=CC=C2C(=C1)C=CN2C3=CC=CC=C3CC(=O)O

CAS RN: 324028-06-0
CAS Name: 2-(2-oxoethylamino)-3-(3,4,5-trifluorophenyl)propanoic acid
OPENEYE Name: 2-(2-oxoethylamino)-3-(3,4,5-trifluorophenyl)propanoic acid
IUPAC Name: 2-(2-oxoethylamino)-3-(3,4,5-trifluorophenyl)propanoic acid
SYSTEMATIC NAME: 2-(2-oxidanylideneethylamino)-3-[3,4,5-tris(fluoranyl)phenyl]propanoic acid
MOLECULAR FORMULA: C11H10F3NO3
MOLECULAR WEIGHT: 261.19721
SMILES: C1=C(C=C(C(=C1F)F)F)CC(C(=O)O)NCC=O

CAS RN: 266360-56-9
CAS Name: 3-(2,6-difluorophenyl)-2-(2-oxoethylamino)propanoic acid
OPENEYE Name: 3-(2,6-difluorophenyl)-2-(2-oxoethylamino)propanoic acid
IUPAC Name: 3-(2,6-difluorophenyl)-2-(2-oxoethylamino)propanoic acid
SYSTEMATIC NAME: 3-[2,6-bis(fluoranyl)phenyl]-2-(2-oxidanylideneethylamino)propanoic acid
MOLECULAR FORMULA: C11H11F2NO3
MOLECULAR WEIGHT: 243.206746
SMILES: C1=CC(=C(C(=C1)F)CC(C(=O)O)NCC=O)F

CAS RN: 266360-55-8
CAS Name: 3-(2,6-difluorophenyl)-2-(2-oxoethylamino)propanoic acid
OPENEYE Name: 3-(2,6-difluorophenyl)-2-(2-oxoethylamino)propanoic acid
IUPAC Name: 3-(2,6-difluorophenyl)-2-(2-oxoethylamino)propanoic acid
SYSTEMATIC NAME: 3-[2,6-bis(fluoranyl)phenyl]-2-(2-oxidanylideneethylamino)propanoic acid
MOLECULAR FORMULA: C11H11F2NO3
MOLECULAR WEIGHT: 243.206746
SMILES: C1=CC(=C(C(=C1)F)CC(C(=O)O)NCC=O)F

CAS RN: 883194-93-2
CAS Name: 4-(4-nitrophenyl)piperidine hydrochloride
OPENEYE Name: 4-(4-nitrophenyl)piperidine hydrochloride
IUPAC Name: 4-(4-nitrophenyl)piperidine hydrochloride
SYSTEMATIC NAME: 4-(4-nitrophenyl)piperidine hydrochloride
MOLECULAR FORMULA: C11H15ClN2O2
MOLECULAR WEIGHT: 242.702
SMILES: C1CNCCC1C2=CC=C(C=C2)[N+](=O)[O-].Cl

CAS RN: 473987-07-4
CAS Name: 4-(4-piperidinyl)butanoic acid ethyl ester hydrochloride
OPENEYE Name: ethyl 4-(4-piperidyl)butanoate hydrochloride
IUPAC Name: ethyl 4-piperidin-4-ylbutanoate hydrochloride
SYSTEMATIC NAME: ethyl 4-piperidin-4-ylbutanoate hydrochloride
MOLECULAR FORMULA: C11H22ClNO2
MOLECULAR WEIGHT: 235.75088
SMILES: CCOC(=O)CCCC1CCNCC1.Cl

CAS RN: 749240-64-0
CAS Name: 4,5,6-trifluoro-1H-indole-2,3-dione
OPENEYE Name: 4,5,6-trifluoroindoline-2,3-dione
IUPAC Name: 4,5,6-trifluoro-1H-indole-2,3-dione
SYSTEMATIC NAME: 4,5,6-tris(fluoranyl)-1H-indole-2,3-dione
MOLECULAR FORMULA: C8H2F3NO2
MOLECULAR WEIGHT: 201.10219
SMILES: C1=C2C(=C(C(=C1F)F)F)C(=O)C(=O)N2

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