5-[(3-methylphenyl)methanesulfonylmethyl]furan-2-carboxylic acid

CAS: 696648-31-4

Formula: C14H14O5S

SMILES: CC1=CC=CC(CS(=O)(=O)CC2=CC=C(O2)C(O)=O)=C1

IUPAC: 5-{[(3-methylphenyl)methanesulfonyl]methyl}furan-2-carboxylic acid

InChI: InChI=1S/C14H14O5S/c1-10-3-2-4-11(7-10)8-20(17,18)9-12-5-6-13(19-12)14(15)16/h2-7H,8-9H2,1H3,(H,15,16)

Composition: C (57.13%), H (4.79%), O (27.18%), S (10.89%)

Molar Mass: 294.32

Atom Count: 34

Heavy Atom Count: 20