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

Systemtic Name: 4-ethyl-N-[[4-[(4-methylpiperazin-4-ium-1-yl)methyl]phenyl]methyl]benzenesulfonamide Openeye Name: 4-ethyl-N-[[4-[(4-methylpiperazin-4-ium-1-yl)methyl]phenyl]methyl]benzenesulfonamide CAS Name: 4-ethyl-N-[[4-[(4-methyl-1-piperazin-4-iumyl)methyl]phenyl]methyl]benzenesulfonamide IUPAC Name: 4-ethyl-N-[[4-[(4-methylpiperazin-4-ium-1-yl)methyl]phenyl]methyl]benzenesulfonamide Traditional Name: 4-ethyl-N-[4-[(4-methylpiperazin-4-ium-1-yl)methyl]benzyl]benzenesulfonamide Formula: C21H30N3O2S+ MolecularWeight: 388.5468

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)S(=O)(=O)NCC2=CC=C(C=C2)CN3CC[NH+](CC3)C

Isomeric SMILES

CCC1=CC=C(C=C1)S(=O)(=O)NCC2=CC=C(C=C2)CN3CC[NH+](CC3)C

InChI

InChI=1S/C21H29N3O2S/c1-3-18-8-10-21(11-9-18)27(25,26)22-16-19-4-6-20(7-5-19)17-24-14-12-23(2)13-15-24/h4-11,22H,3,12-17H2,1-2H3/p+1