Monday, June 27, 2011

http://ChemLookup.com Compounds




CAS RN: 15513-18-5
CAS Name: N-propan-2-yl-2-pyridinamine dihydrochloride
OPENEYE Name: N-isopropylpyridin-2-amine dihydrochloride
IUPAC Name: N-propan-2-ylpyridin-2-amine dihydrochloride
SYSTEMATIC NAME: N-propan-2-ylpyridin-2-amine dihydrochloride
MOLECULAR FORMULA: C8H14Cl2N2
MOLECULAR WEIGHT: 209.11616
SMILES: CC(C)NC1=CC=CC=N1.Cl.Cl

CAS RN: 114744-50-2
CAS Name: 5-bromo-1,2,3,4-tetrahydroquinoline hydrochloride
OPENEYE Name: 5-bromo-1,2,3,4-tetrahydroquinoline hydrochloride
IUPAC Name: 5-bromo-1,2,3,4-tetrahydroquinoline hydrochloride
SYSTEMATIC NAME: 5-bromanyl-1,2,3,4-tetrahydroquinoline hydrochloride
MOLECULAR FORMULA: C9H11BrClN
MOLECULAR WEIGHT: 248.54734
SMILES: C1CC2=C(C=CC=C2Br)NC1.Cl

CAS RN: 867062-95-1
CAS Name: 3-[2-[2-[2-amino-3-(9H-fluoren-9-ylmethoxy)-3-oxopropoxy]ethoxy]ethoxy]propanoic acid
OPENEYE Name: 3-[2-[2-[2-amino-3-(9H-fluoren-9-ylmethoxy)-3-oxo-propoxy]ethoxy]ethoxy]propanoic acid
IUPAC Name: 3-[2-[2-[2-amino-3-(9H-fluoren-9-ylmethoxy)-3-oxopropoxy]ethoxy]ethoxy]propanoic acid
SYSTEMATIC NAME: 3-[2-[2-[2-azanyl-3-(9H-fluoren-9-ylmethoxy)-3-oxidanylidene-propoxy]ethoxy]ethoxy]propanoic acid
MOLECULAR FORMULA: C24H29NO7
MOLECULAR WEIGHT: 443.48956
SMILES: C1=CC=C2C(=C1)C(C3=CC=CC=C32)COC(=O)C(COCCOCCOCCC(=O)O)N

CAS RN: 697300-72-4
CAS Name: 3-bromo-2-fluoro-5-iodopyridine
OPENEYE Name: 3-bromo-2-fluoro-5-iodo-pyridine
IUPAC Name: 3-bromo-2-fluoro-5-iodopyridine
SYSTEMATIC NAME: 3-bromanyl-2-fluoranyl-5-iodanyl-pyridine
MOLECULAR FORMULA: C5H2BrFIN
MOLECULAR WEIGHT: 301.882953
SMILES: C1=C(C(=NC=C1I)F)Br

CAS RN: 112055-80-8
CAS Name: 4-[(2S)-2-amino-2-carboxyethyl]-2-pyridinecarboxylic acid
OPENEYE Name: 4-[(2S)-2-amino-2-carboxy-ethyl]pyridine-2-carboxylic acid
IUPAC Name: 4-[(2S)-2-amino-2-carboxyethyl]pyridine-2-carboxylic acid
SYSTEMATIC NAME: 4-[(2S)-2-azanyl-3-oxidanyl-3-oxidanylidene-propyl]pyridine-2-carboxylic acid
MOLECULAR FORMULA: C9H10N2O4
MOLECULAR WEIGHT: 210.1867
SMILES: C1=CN=C(C=C1C[C@@H](C(=O)O)N)C(=O)O

CAS RN: 66191-23-9
CAS Name: 6-chloro-1-mercapto-2-methylpurine
OPENEYE Name: 6-chloro-2-methyl-1-sulfanyl-purine
IUPAC Name: 6-chloro-2-methyl-1-sulfanylpurine
SYSTEMATIC NAME: 6-chloranyl-2-methyl-1-sulfanyl-purine
MOLECULAR FORMULA: C6H5ClN4S
MOLECULAR WEIGHT: 200.6487
SMILES: CC1=NC2=NC=NC2=C(N1S)Cl

CAS RN: 916220-05-8
CAS Name: 3-(4-chloro-2-methylphenyl)benzoic acid
OPENEYE Name: 3-(4-chloro-2-methyl-phenyl)benzoic acid
IUPAC Name: 3-(4-chloro-2-methylphenyl)benzoic acid
SYSTEMATIC NAME: 3-(4-chloranyl-2-methyl-phenyl)benzoic acid
MOLECULAR FORMULA: C14H11ClO2
MOLECULAR WEIGHT: 246.68894
SMILES: CC1=C(C=CC(=C1)Cl)C2=CC(=CC=C2)C(=O)O

CAS RN: 176433-62-8
CAS Name: 2-chloro-5-hydroxy-3-pyridinecarboxaldehyde
OPENEYE Name: 2-chloro-5-hydroxy-pyridine-3-carbaldehyde
IUPAC Name: 2-chloro-5-hydroxypyridine-3-carbaldehyde
SYSTEMATIC NAME: 2-chloranyl-5-oxidanyl-pyridine-3-carbaldehyde
MOLECULAR FORMULA: C6H4ClNO2
MOLECULAR WEIGHT: 157.55446
SMILES: C1=C(C(=NC=C1O)Cl)C=O

CAS RN: 10438-96-7
CAS Name: [chloro(sulfinato)amino]methane
OPENEYE Name: [chloro(sulfinato)amino]methane
IUPAC Name: [chloro(sulfinato)amino]methane
SYSTEMATIC NAME: [chloranyl(sulfinato)amino]methane
MOLECULAR FORMULA: CH3ClNO2S-
MOLECULAR WEIGHT: 128.55802
SMILES: CN(S(=O)[O-])Cl

CAS RN: 923010-68-8
CAS Name: 2-amino-6-[(2-methylpropan-2-yl)oxy-oxomethyl]-5,7-dihydro-4H-thieno[2,3-c]pyridine-3-carboxylic acid
OPENEYE Name: 2-amino-6-tert-butoxycarbonyl-5,7-dihydro-4H-thieno[2,3-c]pyridine-3-carboxylic acid
IUPAC Name: 2-amino-6-[(2-methylpropan-2-yl)oxycarbonyl]-5,7-dihydro-4H-thieno[2,3-c]pyridine-3-carboxylic acid
SYSTEMATIC NAME: 2-azanyl-6-[(2-methylpropan-2-yl)oxycarbonyl]-5,7-dihydro-4H-thieno[2,3-c]pyridine-3-carboxylic acid
MOLECULAR FORMULA: C13H18N2O4S
MOLECULAR WEIGHT: 298.35802
SMILES: CC(C)(C)OC(=O)N1CCC2=C(C1)SC(=C2C(=O)O)N

CAS RN: 957793-35-0
CAS Name: 3-amino-1-cyclobutanecarboxylic acid ethyl ester
OPENEYE Name: ethyl 3-aminocyclobutanecarboxylate
IUPAC Name: ethyl 3-aminocyclobutane-1-carboxylate
SYSTEMATIC NAME: ethyl 3-azanylcyclobutane-1-carboxylate
MOLECULAR FORMULA: C7H13NO2
MOLECULAR WEIGHT: 143.18362
SMILES: CCOC(=O)C1CC(C1)N

CAS RN: 477727-72-3
CAS Name: 5-[(E)-2-iodoethenyl]-1,2,3-trimethoxybenzene
OPENEYE Name: 5-[(E)-2-iodovinyl]-1,2,3-trimethoxy-benzene
IUPAC Name: 5-[(E)-2-iodoethenyl]-1,2,3-trimethoxybenzene
SYSTEMATIC NAME: 5-[(E)-2-iodanylethenyl]-1,2,3-trimethoxy-benzene
MOLECULAR FORMULA: C11H13IO3
MOLECULAR WEIGHT: 320.12359
SMILES: COC1=CC(=CC(=C1OC)OC)/C=C/I

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