5-[1-[3-(4-methylphenyl)phenyl]-2-sulfonyl-ethoxy]-2-oxidanyl-benzoic acid

Systemtic Name: 5-[1-[3-(4-methylphenyl)phenyl]-2-sulfonyl-ethoxy]-2-oxidanyl-benzoic acid Openeye Name: 2-hydroxy-5-[1-[3-(p-tolyl)phenyl]-2-sulfonyl-ethoxy]benzoic acid CAS Name: 2-hydroxy-5-[1-[3-(4-methylphenyl)phenyl]-2-sulfonylethoxy]benzoic acid IUPAC Name: 2-hydroxy-5-[1-[3-(4-methylphenyl)phenyl]-2-sulfonylethoxy]benzoic acid Traditional Name: 2-hydroxy-5-[1-[3-(p-tolyl)phenyl]-2-sulfonyl-ethoxy]benzoic acid Formula: C22H18O6S MolecularWeight: 410.43972

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=CC(=CC=C2)C(C=S(=O)=O)OC3=CC(=C(C=C3)O)C(=O)O

Isomeric SMILES

CC1=CC=C(C=C1)C2=CC(=CC=C2)C(C=S(=O)=O)OC3=CC(=C(C=C3)O)C(=O)O

InChI

InChI=1S/C22H18O6S/c1-14-5-7-15(8-6-14)16-3-2-4-17(11-16)21(13-29(26)27)28-18-9-10-20(23)19(12-18)22(24)25/h2-13,21,23H,1H3,(H,24,25)