2-methyl-5-[(2-oxidanylideneoxolan-3-yl)sulfamoyl]benzoic acid

Systemtic Name: 2-methyl-5-[(2-oxidanylideneoxolan-3-yl)sulfamoyl]benzoic acid Openeye Name: 2-methyl-5-[(2-oxotetrahydrofuran-3-yl)sulfamoyl]benzoic acid CAS Name: 2-methyl-5-[(2-oxo-3-oxolanyl)sulfamoyl]benzoic acid IUPAC Name: 2-methyl-5-[(2-oxooxolan-3-yl)sulfamoyl]benzoic acid Traditional Name: 5-[(2-ketotetrahydrofuran-3-yl)sulfamoyl]-2-methyl-benzoic acid Formula: C12H13NO6S MolecularWeight: 299.29972

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)NC2CCOC2=O)C(=O)O

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)NC2CCOC2=O)C(=O)O

InChI

InChI=1S/C12H13NO6S/c1-7-2-3-8(6-9(7)11(14)15)20(17,18)13-10-4-5-19-12(10)16/h2-3,6,10,13H,4-5H2,1H3,(H,14,15)