2-[(3-chloranyl-2-ethanoylsulfanyl-phenyl)carbonyl-cyclopentyl-amino]ethanoic acid

Systemtic Name: 2-[(3-chloranyl-2-ethanoylsulfanyl-phenyl)carbonyl-cyclopentyl-amino]ethanoic acid Openeye Name: 2-[(2-acetylsulfanyl-3-chloro-benzoyl)-cyclopentyl-amino]acetic acid CAS Name: 2-[[[2-(acetylthio)-3-chlorophenyl]-oxomethyl]-cyclopentylamino]acetic acid IUPAC Name: 2-[(2-acetylsulfanyl-3-chlorobenzoyl)-cyclopentylamino]acetic acid Traditional Name: 2-[[2-(acetylthio)-3-chloro-benzoyl]-cyclopentyl-amino]acetic acid Formula: C16H18ClNO4S MolecularWeight: 355.83642

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)SC1=C(C=CC=C1Cl)C(=O)N(CC(=O)O)C2CCCC2

Isomeric SMILES

CC(=O)SC1=C(C=CC=C1Cl)C(=O)N(CC(=O)O)C2CCCC2

InChI

InChI=1S/C16H18ClNO4S/c1-10(19)23-15-12(7-4-8-13(15)17)16(22)18(9-14(20)21)11-5-2-3-6-11/h4,7-8,11H,2-3,5-6,9H2,1H3,(H,20,21)