2-[(phenylmethyl)sulfonylmethyl]furan-3-carboxylic acid

Systemtic Name: 2-[(phenylmethyl)sulfonylmethyl]furan-3-carboxylic acid Openeye Name: 2-(benzylsulfonylmethyl)furan-3-carboxylic acid CAS Name: 2-[(phenylmethyl)sulfonylmethyl]-3-furancarboxylic acid IUPAC Name: 2-(benzylsulfonylmethyl)furan-3-carboxylic acid Traditional Name: 2-(benzylsulfonylmethyl)-3-furoic acid Formula: C13H12O5S MolecularWeight: 280.29638

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CS(=O)(=O)CC2=C(C=CO2)C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)CS(=O)(=O)CC2=C(C=CO2)C(=O)O

InChI

InChI=1S/C13H12O5S/c14-13(15)11-6-7-18-12(11)9-19(16,17)8-10-4-2-1-3-5-10/h1-7H,8-9H2,(H,14,15)