4-[2-(4-methylsulfanylphenyl)-2-oxidanylidene-ethyl]benzoic acid

Systemtic Name: 4-[2-(4-methylsulfanylphenyl)-2-oxidanylidene-ethyl]benzoic acid Openeye Name: 4-[2-(4-methylsulfanylphenyl)-2-oxo-ethyl]benzoic acid CAS Name: 4-[2-[4-(methylthio)phenyl]-2-oxoethyl]benzoic acid IUPAC Name: 4-[2-(4-methylsulfanylphenyl)-2-oxoethyl]benzoic acid Traditional Name: 4-[2-keto-2-[4-(methylthio)phenyl]ethyl]benzoic acid Formula: C16H14O3S MolecularWeight: 286.34556

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=C(C=C1)C(=O)CC2=CC=C(C=C2)C(=O)O

Isomeric SMILES

CSC1=CC=C(C=C1)C(=O)CC2=CC=C(C=C2)C(=O)O

InChI

InChI=1S/C16H14O3S/c1-20-14-8-6-12(7-9-14)15(17)10-11-2-4-13(5-3-11)16(18)19/h2-9H,10H2,1H3,(H,18,19)