4-oxidanylidene-4-phenyl-2-(phenylcarbonylsulfanylmethyl)butanoic acid

Systemtic Name: 4-oxidanylidene-4-phenyl-2-(phenylcarbonylsulfanylmethyl)butanoic acid Openeye Name: 2-(benzoylsulfanylmethyl)-4-oxo-4-phenyl-butanoic acid CAS Name: 2-[(benzoylthio)methyl]-4-oxo-4-phenylbutanoic acid IUPAC Name: 2-(benzoylsulfanylmethyl)-4-oxo-4-phenylbutanoic acid Traditional Name: 2-[(benzoylthio)methyl]-4-keto-4-phenyl-butyric acid Formula: C18H16O4S MolecularWeight: 328.38224

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)CC(CSC(=O)C2=CC=CC=C2)C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)C(=O)CC(CSC(=O)C2=CC=CC=C2)C(=O)O

InChI

InChI=1S/C18H16O4S/c19-16(13-7-3-1-4-8-13)11-15(17(20)21)12-23-18(22)14-9-5-2-6-10-14/h1-10,15H,11-12H2,(H,20,21)