3-[(3-methoxy-3-oxidanylidene-propyl)sulfamoyl]-4,5-dimethyl-benzoic acid

Systemtic Name: 3-[(3-methoxy-3-oxidanylidene-propyl)sulfamoyl]-4,5-dimethyl-benzoic acid Openeye Name: 3-[(3-methoxy-3-oxo-propyl)sulfamoyl]-4,5-dimethyl-benzoic acid CAS Name: 3-[(3-methoxy-3-oxopropyl)sulfamoyl]-4,5-dimethylbenzoic acid IUPAC Name: 3-[(3-methoxy-3-oxopropyl)sulfamoyl]-4,5-dimethylbenzoic acid Traditional Name: 3-[(3-keto-3-methoxy-propyl)sulfamoyl]-4,5-dimethyl-benzoic acid Formula: C13H17NO6S MolecularWeight: 315.34218

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC(=C1)C(=O)O)S(=O)(=O)NCCC(=O)OC)C

Isomeric SMILES

CC1=C(C(=CC(=C1)C(=O)O)S(=O)(=O)NCCC(=O)OC)C

InChI

InChI=1S/C13H17NO6S/c1-8-6-10(13(16)17)7-11(9(8)2)21(18,19)14-5-4-12(15)20-3/h6-7,14H,4-5H2,1-3H3,(H,16,17)