4-(4-chlorophenyl)-2-(4-methylphenyl)sulfanyl-4-oxidanylidene-butanoic acid

Systemtic Name: 4-(4-chlorophenyl)-2-(4-methylphenyl)sulfanyl-4-oxidanylidene-butanoic acid Openeye Name: 4-(4-chlorophenyl)-4-oxo-2-(p-tolylsulfanyl)butanoic acid CAS Name: 4-(4-chlorophenyl)-2-[(4-methylphenyl)thio]-4-oxobutanoic acid IUPAC Name: 4-(4-chlorophenyl)-2-(4-methylphenyl)sulfanyl-4-oxobutanoic acid Traditional Name: 4-(4-chlorophenyl)-4-keto-2-(p-tolylthio)butyric acid Formula: C17H15ClO3S MolecularWeight: 334.8172

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)SC(CC(=O)C2=CC=C(C=C2)Cl)C(=O)O

Isomeric SMILES

CC1=CC=C(C=C1)SC(CC(=O)C2=CC=C(C=C2)Cl)C(=O)O

InChI

InChI=1S/C17H15ClO3S/c1-11-2-8-14(9-3-11)22-16(17(20)21)10-15(19)12-4-6-13(18)7-5-12/h2-9,16H,10H2,1H3,(H,20,21)