3,4-dimethyl-5-[(2-oxidanylideneoxolan-3-yl)sulfamoyl]benzoic acid

Systemtic Name: 3,4-dimethyl-5-[(2-oxidanylideneoxolan-3-yl)sulfamoyl]benzoic acid Openeye Name: 3,4-dimethyl-5-[(2-oxotetrahydrofuran-3-yl)sulfamoyl]benzoic acid CAS Name: 3,4-dimethyl-5-[(2-oxo-3-oxolanyl)sulfamoyl]benzoic acid IUPAC Name: 3,4-dimethyl-5-[(2-oxooxolan-3-yl)sulfamoyl]benzoic acid Traditional Name: 3-[(2-ketotetrahydrofuran-3-yl)sulfamoyl]-4,5-dimethyl-benzoic acid Formula: C13H15NO6S MolecularWeight: 313.3263

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H15NO6S/c1-7-5-9(12(15)16)6-11(8(7)2)21(18,19)14-10-3-4-20-13(10)17/h5-6,10,14H,3-4H2,1-2H3,(H,15,16)