2-[4-(4-methylsulfinylphenoxy)phenyl]sulfonylbenzoic acid

Systemtic Name: 2-[4-(4-methylsulfinylphenoxy)phenyl]sulfonylbenzoic acid Openeye Name: 2-[4-(4-methylsulfinylphenoxy)phenyl]sulfonylbenzoic acid CAS Name: 2-[4-(4-methylsulfinylphenoxy)phenyl]sulfonylbenzoic acid IUPAC Name: 2-[4-(4-methylsulfinylphenoxy)phenyl]sulfonylbenzoic acid Traditional Name: 2-[4-(4-methylsulfinylphenoxy)phenyl]sulfonylbenzoic acid Formula: C20H16O6S2 MolecularWeight: 416.46744

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)C1=CC=C(C=C1)OC2=CC=C(C=C2)S(=O)(=O)C3=CC=CC=C3C(=O)O

Isomeric SMILES

CS(=O)C1=CC=C(C=C1)OC2=CC=C(C=C2)S(=O)(=O)C3=CC=CC=C3C(=O)O

InChI

InChI=1S/C20H16O6S2/c1-27(23)16-10-6-14(7-11-16)26-15-8-12-17(13-9-15)28(24,25)19-5-3-2-4-18(19)20(21)22/h2-13H,1H3,(H,21,22)