2-[2-[(4-chlorophenyl)amino]-2-oxidanylidene-1-phenyl-ethyl]sulfanylethanoic acid

Systemtic Name: 2-[2-[(4-chlorophenyl)amino]-2-oxidanylidene-1-phenyl-ethyl]sulfanylethanoic acid Openeye Name: 2-[2-(4-chloroanilino)-2-oxo-1-phenyl-ethyl]sulfanylacetic acid CAS Name: 2-[[2-(4-chloroanilino)-2-oxo-1-phenylethyl]thio]acetic acid IUPAC Name: 2-[2-(4-chloroanilino)-2-oxo-1-phenylethyl]sulfanylacetic acid Traditional Name: 2-[[2-(4-chloroanilino)-2-keto-1-phenyl-ethyl]thio]acetic acid Formula: C16H14ClNO3S MolecularWeight: 335.80526

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(C(=O)NC2=CC=C(C=C2)Cl)SCC(=O)O

Isomeric SMILES

C1=CC=C(C=C1)C(C(=O)NC2=CC=C(C=C2)Cl)SCC(=O)O

InChI

InChI=1S/C16H14ClNO3S/c17-12-6-8-13(9-7-12)18-16(21)15(22-10-14(19)20)11-4-2-1-3-5-11/h1-9,15H,10H2,(H,18,21)(H,19,20)