4-[2-(3-methylphenyl)sulfonylethoxy]-2-oxidanyl-benzoic acid

Systemtic Name: 4-[2-(3-methylphenyl)sulfonylethoxy]-2-oxidanyl-benzoic acid Openeye Name: 2-hydroxy-4-[2-(m-tolylsulfonyl)ethoxy]benzoic acid CAS Name: 2-hydroxy-4-[2-(3-methylphenyl)sulfonylethoxy]benzoic acid IUPAC Name: 2-hydroxy-4-[2-(3-methylphenyl)sulfonylethoxy]benzoic acid Traditional Name: 2-hydroxy-4-[2-(m-tolylsulfonyl)ethoxy]benzoic acid Formula: C16H16O6S MolecularWeight: 336.35964

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)S(=O)(=O)CCOC2=CC(=C(C=C2)C(=O)O)O

Isomeric SMILES

CC1=CC(=CC=C1)S(=O)(=O)CCOC2=CC(=C(C=C2)C(=O)O)O

InChI

InChI=1S/C16H16O6S/c1-11-3-2-4-13(9-11)23(20,21)8-7-22-12-5-6-14(16(18)19)15(17)10-12/h2-6,9-10,17H,7-8H2,1H3,(H,18,19)