4-[2-(2-chlorophenyl)phenyl]-3-ethanoylsulfanyl-butanoic acid

Systemtic Name: 4-[2-(2-chlorophenyl)phenyl]-3-ethanoylsulfanyl-butanoic acid Openeye Name: 3-acetylsulfanyl-4-[2-(2-chlorophenyl)phenyl]butanoic acid CAS Name: 3-(acetylthio)-4-[2-(2-chlorophenyl)phenyl]butanoic acid IUPAC Name: 3-acetylsulfanyl-4-[2-(2-chlorophenyl)phenyl]butanoic acid Traditional Name: 3-(acetylthio)-4-[2-(2-chlorophenyl)phenyl]butyric acid Formula: C18H17ClO3S MolecularWeight: 348.84378

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)SC(CC1=CC=CC=C1C2=CC=CC=C2Cl)CC(=O)O

Isomeric SMILES

CC(=O)SC(CC1=CC=CC=C1C2=CC=CC=C2Cl)CC(=O)O

InChI

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