N-[4-(4-methylpiperazin-4-ium-1-yl)phenyl]-4-propyl-benzenesulfonamide

Systemtic Name: N-[4-(4-methylpiperazin-4-ium-1-yl)phenyl]-4-propyl-benzenesulfonamide Openeye Name: N-[4-(4-methylpiperazin-4-ium-1-yl)phenyl]-4-propyl-benzenesulfonamide CAS Name: N-[4-(4-methyl-1-piperazin-4-iumyl)phenyl]-4-propylbenzenesulfonamide IUPAC Name: N-[4-(4-methylpiperazin-4-ium-1-yl)phenyl]-4-propylbenzenesulfonamide Traditional Name: N-[4-(4-methylpiperazin-4-ium-1-yl)phenyl]-4-propyl-benzenesulfonamide Formula: C20H28N3O2S+ MolecularWeight: 374.52022

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC=C(C=C1)S(=O)(=O)NC2=CC=C(C=C2)N3CC[NH+](CC3)C

Isomeric SMILES

CCCC1=CC=C(C=C1)S(=O)(=O)NC2=CC=C(C=C2)N3CC[NH+](CC3)C

InChI

InChI=1S/C20H27N3O2S/c1-3-4-17-5-11-20(12-6-17)26(24,25)21-18-7-9-19(10-8-18)23-15-13-22(2)14-16-23/h5-12,21H,3-4,13-16H2,1-2H3/p+1