3-methyl-5-[2-(4-methylphenyl)sulfonylethoxy]-2-oxidanyl-benzoic acid

Systemtic Name: 3-methyl-5-[2-(4-methylphenyl)sulfonylethoxy]-2-oxidanyl-benzoic acid Openeye Name: 2-hydroxy-3-methyl-5-[2-(p-tolylsulfonyl)ethoxy]benzoic acid CAS Name: 2-hydroxy-3-methyl-5-[2-(4-methylphenyl)sulfonylethoxy]benzoic acid IUPAC Name: 2-hydroxy-3-methyl-5-[2-(4-methylphenyl)sulfonylethoxy]benzoic acid Traditional Name: 2-hydroxy-3-methyl-5-(2-tosylethoxy)benzoic acid Formula: C17H18O6S MolecularWeight: 350.38622

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H18O6S/c1-11-3-5-14(6-4-11)24(21,22)8-7-23-13-9-12(2)16(18)15(10-13)17(19)20/h3-6,9-10,18H,7-8H2,1-2H3,(H,19,20)