4-[2-(4-methylphenyl)-1-sulfinyl-ethoxy]-2-oxidanyl-benzoic acid

Systemtic Name: 4-[2-(4-methylphenyl)-1-sulfinyl-ethoxy]-2-oxidanyl-benzoic acid Openeye Name: 2-hydroxy-4-[2-(p-tolyl)-1-sulfinyl-ethoxy]benzoic acid CAS Name: 2-hydroxy-4-[2-(4-methylphenyl)-1-sulfinylethoxy]benzoic acid IUPAC Name: 2-hydroxy-4-[2-(4-methylphenyl)-1-sulfinylethoxy]benzoic acid Traditional Name: 2-hydroxy-4-[2-(p-tolyl)-1-sulfinyl-ethoxy]benzoic acid Formula: C16H14O5S MolecularWeight: 318.34436

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CC(=S=O)OC2=CC(=C(C=C2)C(=O)O)O

Isomeric SMILES

CC1=CC=C(C=C1)CC(=S=O)OC2=CC(=C(C=C2)C(=O)O)O

InChI

InChI=1S/C16H14O5S/c1-10-2-4-11(5-3-10)8-15(22-20)21-12-6-7-13(16(18)19)14(17)9-12/h2-7,9,17H,8H2,1H3,(H,18,19)