3,4-dimethyl-5-[methyl(pentyl)sulfamoyl]benzoic acid

Systemtic Name: 3,4-dimethyl-5-[methyl(pentyl)sulfamoyl]benzoic acid Openeye Name: 3,4-dimethyl-5-[methyl(pentyl)sulfamoyl]benzoic acid CAS Name: 3,4-dimethyl-5-[methyl(pentyl)sulfamoyl]benzoic acid IUPAC Name: 3,4-dimethyl-5-[methyl(pentyl)sulfamoyl]benzoic acid Traditional Name: 3-[amyl(methyl)sulfamoyl]-4,5-dimethyl-benzoic acid Formula: C15H23NO4S MolecularWeight: 313.41242

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCN(C)S(=O)(=O)C1=CC(=CC(=C1C)C)C(=O)O

Isomeric SMILES

CCCCCN(C)S(=O)(=O)C1=CC(=CC(=C1C)C)C(=O)O

InChI

InChI=1S/C15H23NO4S/c1-5-6-7-8-16(4)21(19,20)14-10-13(15(17)18)9-11(2)12(14)3/h9-10H,5-8H2,1-4H3,(H,17,18)