3-phenyl-2-(phenylcarbonylsulfanylmethyl)propanoic acid

Systemtic Name: 3-phenyl-2-(phenylcarbonylsulfanylmethyl)propanoic acid Openeye Name: 2-(benzoylsulfanylmethyl)-3-phenyl-propanoic acid CAS Name: 2-[(benzoylthio)methyl]-3-phenylpropanoic acid IUPAC Name: 2-(benzoylsulfanylmethyl)-3-phenylpropanoic acid Traditional Name: 2-[(benzoylthio)methyl]-3-phenyl-propionic acid Formula: C17H16O3S MolecularWeight: 300.37214

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H16O3S/c18-16(19)15(11-13-7-3-1-4-8-13)12-21-17(20)14-9-5-2-6-10-14/h1-10,15H,11-12H2,(H,18,19)