N,N-dimethyl-4-(piperazin-4-ium-1-ylmethyl)benzenesulfonamide

Systemtic Name: N,N-dimethyl-4-(piperazin-4-ium-1-ylmethyl)benzenesulfonamide Openeye Name: N,N-dimethyl-4-(piperazin-4-ium-1-ylmethyl)benzenesulfonamide CAS Name: N,N-dimethyl-4-(1-piperazin-4-iumylmethyl)benzenesulfonamide IUPAC Name: N,N-dimethyl-4-(piperazin-4-ium-1-ylmethyl)benzenesulfonamide Traditional Name: N,N-dimethyl-4-(piperazin-4-ium-1-ylmethyl)benzenesulfonamide Formula: C13H22N3O2S+ MolecularWeight: 284.39768

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(C)S(=O)(=O)C1=CC=C(C=C1)CN2CC[NH2+]CC2

Isomeric SMILES

CN(C)S(=O)(=O)C1=CC=C(C=C1)CN2CC[NH2+]CC2

InChI

InChI=1S/C13H21N3O2S/c1-15(2)19(17,18)13-5-3-12(4-6-13)11-16-9-7-14-8-10-16/h3-6,14H,7-11H2,1-2H3/p+1