5-[(4-methylphenyl)methylsulfonylmethyl]furan-2-carboxylic acid

Systemtic Name: 5-[(4-methylphenyl)methylsulfonylmethyl]furan-2-carboxylic acid Openeye Name: 5-(p-tolylmethylsulfonylmethyl)furan-2-carboxylic acid CAS Name: 5-[(4-methylphenyl)methylsulfonylmethyl]-2-furancarboxylic acid IUPAC Name: 5-[(4-methylphenyl)methylsulfonylmethyl]furan-2-carboxylic acid Traditional Name: 5-[(4-methylbenzyl)sulfonylmethyl]-2-furoic acid Formula: C14H14O5S MolecularWeight: 294.32296

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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