4-[5-[bis(oxidanyl)methyl]-3-(4-methylsulfonylphenyl)thiophen-2-yl]benzoic acid

Systemtic Name: 4-[5-[bis(oxidanyl)methyl]-3-(4-methylsulfonylphenyl)thiophen-2-yl]benzoic acid Openeye Name: 4-[5-(dihydroxymethyl)-3-(4-methylsulfonylphenyl)-2-thienyl]benzoic acid CAS Name: 4-[5-(dihydroxymethyl)-3-(4-methylsulfonylphenyl)-2-thiophenyl]benzoic acid IUPAC Name: 4-[5-(dihydroxymethyl)-3-(4-methylsulfonylphenyl)thiophen-2-yl]benzoic acid Traditional Name: 4-[5-(dihydroxymethyl)-3-(4-mesylphenyl)-2-thienyl]benzoic acid Formula: C19H16O6S2 MolecularWeight: 404.45674

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC=C(C=C1)C2=C(SC(=C2)C(O)O)C3=CC=C(C=C3)C(=O)O

Isomeric SMILES

CS(=O)(=O)C1=CC=C(C=C1)C2=C(SC(=C2)C(O)O)C3=CC=C(C=C3)C(=O)O

InChI

InChI=1S/C19H16O6S2/c1-27(24,25)14-8-6-11(7-9-14)15-10-16(19(22)23)26-17(15)12-2-4-13(5-3-12)18(20)21/h2-10,19,22-23H,1H3,(H,20,21)