N-(2-methylpropyl)-3-piperazin-4-ium-1-yl-benzenesulfonamide

Systemtic Name: N-(2-methylpropyl)-3-piperazin-4-ium-1-yl-benzenesulfonamide Openeye Name: N-isobutyl-3-piperazin-4-ium-1-yl-benzenesulfonamide CAS Name: N-(2-methylpropyl)-3-(1-piperazin-4-iumyl)benzenesulfonamide IUPAC Name: N-(2-methylpropyl)-3-piperazin-4-ium-1-ylbenzenesulfonamide Traditional Name: N-isobutyl-3-piperazin-4-ium-1-yl-benzenesulfonamide Formula: C14H24N3O2S+ MolecularWeight: 298.42426

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CNS(=O)(=O)C1=CC=CC(=C1)N2CC[NH2+]CC2

Isomeric SMILES

CC(C)CNS(=O)(=O)C1=CC=CC(=C1)N2CC[NH2+]CC2

InChI

InChI=1S/C14H23N3O2S/c1-12(2)11-16-20(18,19)14-5-3-4-13(10-14)17-8-6-15-7-9-17/h3-5,10,12,15-16H,6-9,11H2,1-2H3/p+1