Saturday, April 28, 2012

http://ChemLookup.com Compounds




CAS RN: 837-52-5
CAS Name: 7-chloro-4-(1-piperazinyl)quinoline
OPENEYE Name: 7-chloro-4-piperazin-1-yl-quinoline
IUPAC Name: 7-chloro-4-piperazin-1-ylquinoline
SYSTEMATIC NAME: 7-chloranyl-4-piperazin-1-yl-quinoline
MOLECULAR FORMULA: C13H14ClN3
MOLECULAR WEIGHT: 247.72336
SMILES: C1CN(CCN1)C2=C3C=CC(=CC3=NC=C2)Cl
Structure:

CAS RN: 167355-47-7
CAS Name: N-[[(4-phenyl-2-thiazolyl)amino]-sulfanylidenemethyl]-2-furancarboxamide
OPENEYE Name: N-[(4-phenylthiazol-2-yl)carbamothioyl]furan-2-carboxamide
IUPAC Name: N-[(4-phenyl-1,3-thiazol-2-yl)carbamothioyl]furan-2-carboxamide
SYSTEMATIC NAME: N-[(4-phenyl-1,3-thiazol-2-yl)carbamothioyl]furan-2-carboxamide
MOLECULAR FORMULA: C15H11N3O2S2
MOLECULAR WEIGHT: 329.39674
SMILES: C1=CC=C(C=C1)C2=CSC(=N2)NC(=S)NC(=O)C3=CC=CO3
Structure:

CAS RN: 379724-54-6
CAS Name: 1-[(4-chlorophenyl)-oxomethyl]-4-piperidinecarboxylic acid
OPENEYE Name: 1-(4-chlorobenzoyl)piperidine-4-carboxylic acid
IUPAC Name: 1-(4-chlorobenzoyl)piperidine-4-carboxylic acid
SYSTEMATIC NAME: 1-(4-chlorophenyl)carbonylpiperidine-4-carboxylic acid
MOLECULAR FORMULA: C13H14ClNO3
MOLECULAR WEIGHT: 267.70816
SMILES: C1CN(CCC1C(=O)O)C(=O)C2=CC=C(C=C2)Cl
Structure:

CAS RN: 695149-42-9
CAS Name: (3S)-3-amino-3-(3-hydroxyphenyl)propanoic acid
OPENEYE Name: (3S)-3-amino-3-(3-hydroxyphenyl)propanoic acid
IUPAC Name: (3S)-3-amino-3-(3-hydroxyphenyl)propanoic acid
SYSTEMATIC NAME: (3S)-3-azanyl-3-(3-hydroxyphenyl)propanoic acid
MOLECULAR FORMULA: C9H11NO3
MOLECULAR WEIGHT: 181.18854
SMILES: C1=CC(=CC(=C1)O)[C@H](CC(=O)O)N
Structure:

CAS RN: 2622-63-1
CAS Name: (3R)-3-amino-3-(3-hydroxyphenyl)propanoic acid
OPENEYE Name: (3R)-3-amino-3-(3-hydroxyphenyl)propanoic acid
IUPAC Name: (3R)-3-amino-3-(3-hydroxyphenyl)propanoic acid
SYSTEMATIC NAME: (3R)-3-azanyl-3-(3-hydroxyphenyl)propanoic acid
MOLECULAR FORMULA: C9H11NO3
MOLECULAR WEIGHT: 181.18854
SMILES: C1=CC(=CC(=C1)O)[C@@H](CC(=O)O)N
Structure:

CAS RN: 210963-95-4
CAS Name: 6-(1-pyrrolidinyl)-3-pyridinecarboxylic acid
OPENEYE Name: 6-pyrrolidin-1-ylpyridine-3-carboxylic acid
IUPAC Name: 6-pyrrolidin-1-ylpyridine-3-carboxylic acid
SYSTEMATIC NAME: 6-pyrrolidin-1-ylpyridine-3-carboxylic acid
MOLECULAR FORMULA: C10H12N2O2
MOLECULAR WEIGHT: 192.21448
SMILES: C1CCN(C1)C2=NC=C(C=C2)C(=O)O
Structure:

CAS RN: 275826-35-2
CAS Name: (3S)-3-amino-3-(3-bromophenyl)propanoic acid
OPENEYE Name: (3S)-3-amino-3-(3-bromophenyl)propanoic acid
IUPAC Name: (3S)-3-amino-3-(3-bromophenyl)propanoic acid
SYSTEMATIC NAME: (3S)-3-azanyl-3-(3-bromophenyl)propanoic acid
MOLECULAR FORMULA: C9H10BrNO2
MOLECULAR WEIGHT: 244.0852
SMILES: C1=CC(=CC(=C1)Br)[C@H](CC(=O)O)N
Structure:

CAS RN: 723284-79-5
CAS Name: (3S)-3-amino-3-(3-fluorophenyl)propanoic acid
OPENEYE Name: (3S)-3-amino-3-(3-fluorophenyl)propanoic acid
IUPAC Name: (3S)-3-amino-3-(3-fluorophenyl)propanoic acid
SYSTEMATIC NAME: (3S)-3-azanyl-3-(3-fluorophenyl)propanoic acid
MOLECULAR FORMULA: C9H10FNO2
MOLECULAR WEIGHT: 183.179603
SMILES: C1=CC(=CC(=C1)F)[C@H](CC(=O)O)N
Structure:

CAS RN: 7261-72-5
CAS Name: (3S)-3-amino-3-(1,3-benzodioxol-5-yl)propanoic acid
OPENEYE Name: (3S)-3-amino-3-(1,3-benzodioxol-5-yl)propanoic acid
IUPAC Name: (3S)-3-amino-3-(1,3-benzodioxol-5-yl)propanoic acid
SYSTEMATIC NAME: (3S)-3-azanyl-3-(1,3-benzodioxol-5-yl)propanoic acid
MOLECULAR FORMULA: C10H11NO4
MOLECULAR WEIGHT: 209.19864
SMILES: C1OC2=C(O1)C=C(C=C2)[C@H](CC(=O)O)N
Structure:

CAS RN: 72616-76-3
CAS Name: (3R)-3-amino-3-(1,3-benzodioxol-5-yl)propanoic acid
OPENEYE Name: (3R)-3-amino-3-(1,3-benzodioxol-5-yl)propanoic acid
IUPAC Name: (3R)-3-amino-3-(1,3-benzodioxol-5-yl)propanoic acid
SYSTEMATIC NAME: (3R)-3-azanyl-3-(1,3-benzodioxol-5-yl)propanoic acid
MOLECULAR FORMULA: C10H11NO4
MOLECULAR WEIGHT: 209.19864
SMILES: C1OC2=C(O1)C=C(C=C2)[C@@H](CC(=O)O)N
Structure:

CAS RN: 6972-45-8
CAS Name: (2R,4R)-2-(4-bromophenyl)-4-thiazolidinecarboxylic acid
OPENEYE Name: (2R,4R)-2-(4-bromophenyl)thiazolidine-4-carboxylic acid
IUPAC Name: (2R,4R)-2-(4-bromophenyl)-1,3-thiazolidine-4-carboxylic acid
SYSTEMATIC NAME: (2R,4R)-2-(4-bromophenyl)-1,3-thiazolidine-4-carboxylic acid
MOLECULAR FORMULA: C10H10BrNO2S
MOLECULAR WEIGHT: 288.1609
SMILES: C1[C@H](N[C@H](S1)C2=CC=C(C=C2)Br)C(=O)O
Structure:

CAS RN: 6972-44-7
CAS Name: (2S,4R)-2-(4-bromophenyl)-4-thiazolidinecarboxylic acid
OPENEYE Name: (2S,4R)-2-(4-bromophenyl)thiazolidine-4-carboxylic acid
IUPAC Name: (2S,4R)-2-(4-bromophenyl)-1,3-thiazolidine-4-carboxylic acid
SYSTEMATIC NAME: (2S,4R)-2-(4-bromophenyl)-1,3-thiazolidine-4-carboxylic acid
MOLECULAR FORMULA: C10H10BrNO2S
MOLECULAR WEIGHT: 288.1609
SMILES: C1[C@H](N[C@@H](S1)C2=CC=C(C=C2)Br)C(=O)O
Structure:

CAS RN: 6972-42-5
CAS Name: (2R,4S)-2-(4-bromophenyl)-4-thiazolidinecarboxylic acid
OPENEYE Name: (2R,4S)-2-(4-bromophenyl)thiazolidine-4-carboxylic acid
IUPAC Name: (2R,4S)-2-(4-bromophenyl)-1,3-thiazolidine-4-carboxylic acid
SYSTEMATIC NAME: (2R,4S)-2-(4-bromophenyl)-1,3-thiazolidine-4-carboxylic acid
MOLECULAR FORMULA: C10H10BrNO2S
MOLECULAR WEIGHT: 288.1609
SMILES: C1[C@@H](N[C@H](S1)C2=CC=C(C=C2)Br)C(=O)O
Structure:

CAS RN: 6972-41-4
CAS Name: (2S,4S)-2-(4-bromophenyl)-4-thiazolidinecarboxylic acid
OPENEYE Name: (2S,4S)-2-(4-bromophenyl)thiazolidine-4-carboxylic acid
IUPAC Name: (2S,4S)-2-(4-bromophenyl)-1,3-thiazolidine-4-carboxylic acid
SYSTEMATIC NAME: (2S,4S)-2-(4-bromophenyl)-1,3-thiazolidine-4-carboxylic acid
MOLECULAR FORMULA: C10H10BrNO2S
MOLECULAR WEIGHT: 288.1609
SMILES: C1[C@@H](N[C@@H](S1)C2=CC=C(C=C2)Br)C(=O)O
Structure:

CAS RN: 62625-24-5
CAS Name: (2R)-2-amino-2-(4-chlorophenyl)acetic acid
OPENEYE Name: (2R)-2-amino-2-(4-chlorophenyl)acetic acid
IUPAC Name: (2R)-2-amino-2-(4-chlorophenyl)acetic acid
SYSTEMATIC NAME: (2R)-2-azanyl-2-(4-chlorophenyl)ethanoic acid
MOLECULAR FORMULA: C8H8ClNO2
MOLECULAR WEIGHT: 185.60762
SMILES: C1=CC(=CC=C1[C@H](C(=O)O)N)Cl
Structure:

CAS RN: 43189-37-3
CAS Name: (2R)-2-amino-2-(4-chlorophenyl)acetic acid
OPENEYE Name: (2R)-2-amino-2-(4-chlorophenyl)acetic acid
IUPAC Name: (2R)-2-amino-2-(4-chlorophenyl)acetic acid
SYSTEMATIC NAME: (2R)-2-azanyl-2-(4-chlorophenyl)ethanoic acid
MOLECULAR FORMULA: C8H8ClNO2
MOLECULAR WEIGHT: 185.60762
SMILES: C1=CC(=CC=C1[C@H](C(=O)O)N)Cl
Structure:

CAS RN: 67845-53-8
CAS Name: (2S)-2-amino-2-(4-chlorophenyl)acetic acid
OPENEYE Name: (2S)-2-amino-2-(4-chlorophenyl)acetic acid
IUPAC Name: (2S)-2-amino-2-(4-chlorophenyl)acetic acid
SYSTEMATIC NAME: (2S)-2-azanyl-2-(4-chlorophenyl)ethanoic acid
MOLECULAR FORMULA: C8H8ClNO2
MOLECULAR WEIGHT: 185.60762
SMILES: C1=CC(=CC=C1[C@@H](C(=O)O)N)Cl
Structure:

CAS RN: 68444-04-2
CAS Name: (3S)-3-amino-3-(3-chlorophenyl)propanoic acid
OPENEYE Name: (3S)-3-amino-3-(3-chlorophenyl)propanoic acid
IUPAC Name: (3S)-3-amino-3-(3-chlorophenyl)propanoic acid
SYSTEMATIC NAME: (3S)-3-azanyl-3-(3-chlorophenyl)propanoic acid
MOLECULAR FORMULA: C9H10ClNO2
MOLECULAR WEIGHT: 199.6342
SMILES: C1=CC(=CC(=C1)Cl)[C@H](CC(=O)O)N
Structure:

CAS RN: 774178-18-6
CAS Name: (3S)-3-amino-3-(3-chlorophenyl)propanoic acid
OPENEYE Name: (3S)-3-amino-3-(3-chlorophenyl)propanoic acid
IUPAC Name: (3S)-3-amino-3-(3-chlorophenyl)propanoic acid
SYSTEMATIC NAME: (3S)-3-azanyl-3-(3-chlorophenyl)propanoic acid
MOLECULAR FORMULA: C9H10ClNO2
MOLECULAR WEIGHT: 199.6342
SMILES: C1=CC(=CC(=C1)Cl)[C@H](CC(=O)O)N
Structure:

CAS RN: 68444-03-1
CAS Name: (3R)-3-amino-3-(3-chlorophenyl)propanoic acid
OPENEYE Name: (3R)-3-amino-3-(3-chlorophenyl)propanoic acid
IUPAC Name: (3R)-3-amino-3-(3-chlorophenyl)propanoic acid
SYSTEMATIC NAME: (3R)-3-azanyl-3-(3-chlorophenyl)propanoic acid
MOLECULAR FORMULA: C9H10ClNO2
MOLECULAR WEIGHT: 199.6342
SMILES: C1=CC(=CC(=C1)Cl)[C@@H](CC(=O)O)N
Structure:

CAS RN: 68443-96-9
CAS Name: (3S)-3-amino-3-(4-methylphenyl)propanoic acid
OPENEYE Name: (3S)-3-amino-3-(p-tolyl)propanoic acid
IUPAC Name: (3S)-3-amino-3-(4-methylphenyl)propanoic acid
SYSTEMATIC NAME: (3S)-3-azanyl-3-(4-methylphenyl)propanoic acid
MOLECULAR FORMULA: C10H13NO2
MOLECULAR WEIGHT: 179.21572
SMILES: CC1=CC=C(C=C1)[C@H](CC(=O)O)N
Structure:

CAS RN: 479065-00-4
CAS Name: (3S)-3-amino-3-(4-methylphenyl)propanoic acid
OPENEYE Name: (3S)-3-amino-3-(p-tolyl)propanoic acid
IUPAC Name: (3S)-3-amino-3-(4-methylphenyl)propanoic acid
SYSTEMATIC NAME: (3S)-3-azanyl-3-(4-methylphenyl)propanoic acid
MOLECULAR FORMULA: C10H13NO2
MOLECULAR WEIGHT: 179.21572
SMILES: CC1=CC=C(C=C1)[C@H](CC(=O)O)N
Structure:

CAS RN: 68443-95-8
CAS Name: (3R)-3-amino-3-(4-methylphenyl)propanoic acid
OPENEYE Name: (3R)-3-amino-3-(p-tolyl)propanoic acid
IUPAC Name: (3R)-3-amino-3-(4-methylphenyl)propanoic acid
SYSTEMATIC NAME: (3R)-3-azanyl-3-(4-methylphenyl)propanoic acid
MOLECULAR FORMULA: C10H13NO2
MOLECULAR WEIGHT: 179.21572
SMILES: CC1=CC=C(C=C1)[C@@H](CC(=O)O)N
Structure:

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