1-(4-methylphenyl)-N-[3-(4-methylpiperazin-4-ium-1-yl)propyl]methanesulfonamide

Systemtic Name: 1-(4-methylphenyl)-N-[3-(4-methylpiperazin-4-ium-1-yl)propyl]methanesulfonamide Openeye Name: N-[3-(4-methylpiperazin-4-ium-1-yl)propyl]-1-(p-tolyl)methanesulfonamide CAS Name: 1-(4-methylphenyl)-N-[3-(4-methyl-1-piperazin-4-iumyl)propyl]methanesulfonamide IUPAC Name: 1-(4-methylphenyl)-N-[3-(4-methylpiperazin-4-ium-1-yl)propyl]methanesulfonamide Traditional Name: N-[3-(4-methylpiperazin-4-ium-1-yl)propyl]-1-(p-tolyl)methanesulfonamide Formula: C16H28N3O2S+ MolecularWeight: 326.47742

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CS(=O)(=O)NCCCN2CC[NH+](CC2)C

Isomeric SMILES

CC1=CC=C(C=C1)CS(=O)(=O)NCCCN2CC[NH+](CC2)C

InChI

InChI=1S/C16H27N3O2S/c1-15-4-6-16(7-5-15)14-22(20,21)17-8-3-9-19-12-10-18(2)11-13-19/h4-7,17H,3,8-14H2,1-2H3/p+1