4-[2-(2-chlorophenyl)phenyl]-2-ethanoylsulfanyl-butanoic acid

Systemtic Name: 4-[2-(2-chlorophenyl)phenyl]-2-ethanoylsulfanyl-butanoic acid Openeye Name: 2-acetylsulfanyl-4-[2-(2-chlorophenyl)phenyl]butanoic acid CAS Name: 2-(acetylthio)-4-[2-(2-chlorophenyl)phenyl]butanoic acid IUPAC Name: 2-acetylsulfanyl-4-[2-(2-chlorophenyl)phenyl]butanoic acid Traditional Name: 2-(acetylthio)-4-[2-(2-chlorophenyl)phenyl]butyric acid Formula: C18H17ClO3S MolecularWeight: 348.84378

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)SC(CCC1=CC=CC=C1C2=CC=CC=C2Cl)C(=O)O

Isomeric SMILES

CC(=O)SC(CCC1=CC=CC=C1C2=CC=CC=C2Cl)C(=O)O

InChI

InChI=1S/C18H17ClO3S/c1-12(20)23-17(18(21)22)11-10-13-6-2-3-7-14(13)15-8-4-5-9-16(15)19/h2-9,17H,10-11H2,1H3,(H,21,22)