Monday, June 27, 2011

http://ChemLookup.com Compounds




CAS RN: 861559-78-6
CAS Name: 2,6-dibromo-4-chloro-3-methylaniline
OPENEYE Name: 2,6-dibromo-4-chloro-3-methyl-aniline
IUPAC Name: 2,6-dibromo-4-chloro-3-methylaniline
SYSTEMATIC NAME: 2,6-bis(bromanyl)-4-chloranyl-3-methyl-aniline
MOLECULAR FORMULA: C7H6Br2ClN
MOLECULAR WEIGHT: 299.39024
SMILES: CC1=C(C(=C(C=C1Cl)Br)N)Br

CAS RN: 1092350-32-7
CAS Name: 2-bromo-3,5-dichloro-4-fluoroaniline
OPENEYE Name: 2-bromo-3,5-dichloro-4-fluoro-aniline
IUPAC Name: 2-bromo-3,5-dichloro-4-fluoroaniline
SYSTEMATIC NAME: 2-bromanyl-3,5-bis(chloranyl)-4-fluoranyl-aniline
MOLECULAR FORMULA: C6H3BrCl2FN
MOLECULAR WEIGHT: 258.903123
SMILES: C1=C(C(=C(C(=C1Cl)F)Cl)Br)N

CAS RN: 122848-57-1
CAS Name: 3,6-diazabicyclo[3.2.0]heptane-6-carboxylic acid tert-butyl ester
OPENEYE Name: tert-butyl 3,6-diazabicyclo[3.2.0]heptane-6-carboxylate
IUPAC Name: tert-butyl 3,6-diazabicyclo[3.2.0]heptane-6-carboxylate
SYSTEMATIC NAME: tert-butyl 3,6-diazabicyclo[3.2.0]heptane-6-carboxylate
MOLECULAR FORMULA: C10H18N2O2
MOLECULAR WEIGHT: 198.26212
SMILES: CC(C)(C)OC(=O)N1CC2C1CNC2

CAS RN: 73657-24-6
CAS Name: (3S,4R)-4,7,7-trimethyl-3-bicyclo[2.2.1]heptanamine hydrochloride
OPENEYE Name: (1R,2S)-1,7,7-trimethylnorbornan-2-amine hydrochloride
IUPAC Name: (3S,4R)-4,7,7-trimethylbicyclo[2.2.1]heptan-3-amine hydrochloride
SYSTEMATIC NAME: (3S,4R)-4,7,7-trimethylbicyclo[2.2.1]heptan-3-amine hydrochloride
MOLECULAR FORMULA: C10H20ClN
MOLECULAR WEIGHT: 189.7255
SMILES: C[C@@]12CCC(C1(C)C)C[C@@H]2N.Cl

CAS RN: 186028-80-8
CAS Name: 1-(1,3-benzodioxol-5-yl)-2-(methylamino)-1-propanone hydrochloride
OPENEYE Name: 1-(1,3-benzodioxol-5-yl)-2-(methylamino)propan-1-one hydrochloride
IUPAC Name: 1-(1,3-benzodioxol-5-yl)-2-(methylamino)propan-1-one hydrochloride
SYSTEMATIC NAME: 1-(1,3-benzodioxol-5-yl)-2-(methylamino)propan-1-one hydrochloride
MOLECULAR FORMULA: C11H14ClNO3
MOLECULAR WEIGHT: 243.68676
SMILES: CC(C(=O)C1=CC2=C(C=C1)OCO2)NC.Cl

CAS RN: 170701-93-6
CAS Name: 2-[4-(phenylmethyl)-3-morpholinyl]acetonitrile
OPENEYE Name: 2-(4-benzylmorpholin-3-yl)acetonitrile
IUPAC Name: 2-(4-benzylmorpholin-3-yl)acetonitrile
SYSTEMATIC NAME: 2-[4-(phenylmethyl)morpholin-3-yl]ethanenitrile
MOLECULAR FORMULA: C13H16N2O
MOLECULAR WEIGHT: 216.27894
SMILES: C1COCC(N1CC2=CC=CC=C2)CC#N

CAS RN: 60241-98-7
CAS Name: 2-benzamido-2-(2-chlorophenyl)acetic acid
OPENEYE Name: 2-benzamido-2-(2-chlorophenyl)acetic acid
IUPAC Name: 2-benzamido-2-(2-chlorophenyl)acetic acid
SYSTEMATIC NAME: 2-benzamido-2-(2-chlorophenyl)ethanoic acid
MOLECULAR FORMULA: C15H12ClNO3
MOLECULAR WEIGHT: 289.71368
SMILES: C1=CC=C(C=C1)C(=O)NC(C2=CC=CC=C2Cl)C(=O)O

CAS RN: 180285-25-0
CAS Name: 1-(phenylmethyl)-2-piperazinecarboxylic acid
OPENEYE Name: 1-benzylpiperazine-2-carboxylic acid
IUPAC Name: 1-benzylpiperazine-2-carboxylic acid
SYSTEMATIC NAME: 1-(phenylmethyl)piperazine-2-carboxylic acid
MOLECULAR FORMULA: C12H16N2O2
MOLECULAR WEIGHT: 220.26764
SMILES: C1CN(C(CN1)C(=O)O)CC2=CC=CC=C2

CAS RN: 942631-51-8
CAS Name: 5-thiazolamine hydrochloride
OPENEYE Name: thiazol-5-amine hydrochloride
IUPAC Name: 1,3-thiazol-5-amine hydrochloride
SYSTEMATIC NAME: 1,3-thiazol-5-amine hydrochloride
MOLECULAR FORMULA: C3H5ClN2S
MOLECULAR WEIGHT: 136.6032
SMILES: C1=C(SC=N1)N.Cl

CAS RN: 920313-27-5
CAS Name: 2-amino-5-thiazolecarboxaldehyde hydrochloride
OPENEYE Name: 2-aminothiazole-5-carbaldehyde hydrochloride
IUPAC Name: 2-amino-1,3-thiazole-5-carbaldehyde hydrochloride
SYSTEMATIC NAME: 2-azanyl-1,3-thiazole-5-carbaldehyde hydrochloride
MOLECULAR FORMULA: C4H5ClN2OS
MOLECULAR WEIGHT: 164.6133
SMILES: C1=C(SC(=N1)N)C=O.Cl

CAS RN: 811842-15-6
CAS Name: 2-(aminomethyl)-3,4-dihydro-2H-quinoline-1-carboxylic acid tert-butyl ester hydrochloride
OPENEYE Name: tert-butyl 2-(aminomethyl)-3,4-dihydro-2H-quinoline-1-carboxylate hydrochloride
IUPAC Name: tert-butyl 2-(aminomethyl)-3,4-dihydro-2H-quinoline-1-carboxylate hydrochloride
SYSTEMATIC NAME: tert-butyl 2-(aminomethyl)-3,4-dihydro-2H-quinoline-1-carboxylate hydrochloride
MOLECULAR FORMULA: C15H23ClN2O2
MOLECULAR WEIGHT: 298.80832
SMILES: CC(C)(C)OC(=O)N1C(CCC2=CC=CC=C21)CN.Cl

CAS RN: 879666-37-2
CAS Name: 3-(2-aminoethyl)aniline dihydrochloride
OPENEYE Name: 3-(2-aminoethyl)aniline dihydrochloride
IUPAC Name: 3-(2-aminoethyl)aniline dihydrochloride
SYSTEMATIC NAME: 3-(2-azanylethyl)aniline dihydrochloride
MOLECULAR FORMULA: C8H14Cl2N2
MOLECULAR WEIGHT: 209.11616
SMILES: C1=CC(=CC(=C1)N)CCN.Cl.Cl

CAS RN: 80914-37-0
CAS Name: 3-aminopentanoic acid hydrochloride
OPENEYE Name: 3-aminopentanoic acid hydrochloride
IUPAC Name: 3-aminopentanoic acid hydrochloride
SYSTEMATIC NAME: 3-azanylpentanoic acid hydrochloride
MOLECULAR FORMULA: C5H12ClNO2
MOLECULAR WEIGHT: 153.60728
SMILES: CCC(CC(=O)O)N.Cl

CAS RN: 143394-93-8
CAS Name: (3R)-3-aminooxolane-2,5-dione hydrochloride
OPENEYE Name: (3R)-3-aminotetrahydrofuran-2,5-dione hydrochloride
IUPAC Name: (3R)-3-aminooxolane-2,5-dione hydrochloride
SYSTEMATIC NAME: (3R)-3-azanyloxolane-2,5-dione hydrochloride
MOLECULAR FORMULA: C4H6ClNO3
MOLECULAR WEIGHT: 151.54834
SMILES: C1[C@H](C(=O)OC1=O)N.Cl

CAS RN: 34403-46-8
CAS Name: [4-(aminomethyl)phenyl]methanol hydrochloride
OPENEYE Name: [4-(aminomethyl)phenyl]methanol hydrochloride
IUPAC Name: [4-(aminomethyl)phenyl]methanol hydrochloride
SYSTEMATIC NAME: [4-(aminomethyl)phenyl]methanol hydrochloride
MOLECULAR FORMULA: C8H12ClNO
MOLECULAR WEIGHT: 173.63998
SMILES: C1=CC(=CC=C1CN)CO.Cl

CAS RN: 910443-85-5
CAS Name: 2-(aminomethyl)-3-(2-bromophenyl)propanoic acid
OPENEYE Name: 2-(aminomethyl)-3-(2-bromophenyl)propanoic acid
IUPAC Name: 2-(aminomethyl)-3-(2-bromophenyl)propanoic acid
SYSTEMATIC NAME: 2-(aminomethyl)-3-(2-bromophenyl)propanoic acid
MOLECULAR FORMULA: C10H12BrNO2
MOLECULAR WEIGHT: 258.11178
SMILES: C1=CC=C(C(=C1)CC(CN)C(=O)O)Br

CAS RN: 910443-86-6
CAS Name: 2-(aminomethyl)-3-(3-bromophenyl)propanoic acid
OPENEYE Name: 2-(aminomethyl)-3-(3-bromophenyl)propanoic acid
IUPAC Name: 2-(aminomethyl)-3-(3-bromophenyl)propanoic acid
SYSTEMATIC NAME: 2-(aminomethyl)-3-(3-bromophenyl)propanoic acid
MOLECULAR FORMULA: C10H12BrNO2
MOLECULAR WEIGHT: 258.11178
SMILES: C1=CC(=CC(=C1)Br)CC(CN)C(=O)O

CAS RN: 910443-87-7
CAS Name: 2-(aminomethyl)-3-(4-bromophenyl)propanoic acid
OPENEYE Name: 2-(aminomethyl)-3-(4-bromophenyl)propanoic acid
IUPAC Name: 2-(aminomethyl)-3-(4-bromophenyl)propanoic acid
SYSTEMATIC NAME: 2-(aminomethyl)-3-(4-bromophenyl)propanoic acid
MOLECULAR FORMULA: C10H12BrNO2
MOLECULAR WEIGHT: 258.11178
SMILES: C1=CC(=CC=C1CC(CN)C(=O)O)Br

CAS RN: 886364-12-1
CAS Name: 3-amino-3-(4-aminophenyl)-1-propanol dihydrochloride
OPENEYE Name: 3-amino-3-(4-aminophenyl)propan-1-ol dihydrochloride
IUPAC Name: 3-amino-3-(4-aminophenyl)propan-1-ol dihydrochloride
SYSTEMATIC NAME: 3-(4-aminophenyl)-3-azanyl-propan-1-ol dihydrochloride
MOLECULAR FORMULA: C9H16Cl2N2O
MOLECULAR WEIGHT: 239.14214
SMILES: C1=CC(=CC=C1C(CCO)N)N.Cl.Cl

CAS RN: 87855-72-9
CAS Name: 2-amino-4-bromophenol hydrochloride
OPENEYE Name: 2-amino-4-bromo-phenol hydrochloride
IUPAC Name: 2-amino-4-bromophenol hydrochloride
SYSTEMATIC NAME: 2-azanyl-4-bromanyl-phenol hydrochloride
MOLECULAR FORMULA: C6H7BrClNO
MOLECULAR WEIGHT: 224.48288
SMILES: C1=CC(=C(C=C1Br)N)O.Cl

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