2-(4-methylsulfonylphenyl)sulfanylbenzoic acid

Systemtic Name: 2-(4-methylsulfonylphenyl)sulfanylbenzoic acid Openeye Name: 2-(4-methylsulfonylphenyl)sulfanylbenzoic acid CAS Name: 2-[(4-methylsulfonylphenyl)thio]benzoic acid IUPAC Name: 2-(4-methylsulfonylphenyl)sulfanylbenzoic acid Traditional Name: 2-[(4-mesylphenyl)thio]benzoic acid Formula: C14H12O4S2 MolecularWeight: 308.37268

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC=C(C=C1)SC2=CC=CC=C2C(=O)O

Isomeric SMILES

CS(=O)(=O)C1=CC=C(C=C1)SC2=CC=CC=C2C(=O)O

InChI

InChI=1S/C14H12O4S2/c1-20(17,18)11-8-6-10(7-9-11)19-13-5-3-2-4-12(13)14(15)16/h2-9H,1H3,(H,15,16)