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

Systemtic Name: 2-[(3-chloranyl-2-ethanethioyl-phenyl)carbonyl-cyclopentyl-amino]ethanoic acid Openeye Name: 2-[(3-chloro-2-ethanethioyl-benzoyl)-cyclopentyl-amino]acetic acid CAS Name: 2-[[[3-chloro-2-(1-sulfanylideneethyl)phenyl]-oxomethyl]-cyclopentylamino]acetic acid IUPAC Name: 2-[(3-chloro-2-ethanethioylbenzoyl)-cyclopentylamino]acetic acid Traditional Name: 2-[(3-chloro-2-thioacetyl-benzoyl)-cyclopentyl-amino]acetic acid Formula: C16H18ClNO3S MolecularWeight: 339.83702

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=S)C1=C(C=CC=C1Cl)C(=O)N(CC(=O)O)C2CCCC2

Isomeric SMILES

CC(=S)C1=C(C=CC=C1Cl)C(=O)N(CC(=O)O)C2CCCC2

InChI

InChI=1S/C16H18ClNO3S/c1-10(22)15-12(7-4-8-13(15)17)16(21)18(9-14(19)20)11-5-2-3-6-11/h4,7-8,11H,2-3,5-6,9H2,1H3,(H,19,20)