N-(4-methylphenyl)-N-[4-(4-methylpiperazin-4-ium-1-yl)-4-oxidanylidene-butyl]methanesulfonamide

Systemtic Name: N-(4-methylphenyl)-N-[4-(4-methylpiperazin-4-ium-1-yl)-4-oxidanylidene-butyl]methanesulfonamide Openeye Name: N-[4-(4-methylpiperazin-4-ium-1-yl)-4-oxo-butyl]-N-(p-tolyl)methanesulfonamide CAS Name: N-(4-methylphenyl)-N-[4-(4-methyl-1-piperazin-4-iumyl)-4-oxobutyl]methanesulfonamide IUPAC Name: N-(4-methylphenyl)-N-[4-(4-methylpiperazin-4-ium-1-yl)-4-oxobutyl]methanesulfonamide Traditional Name: N-[4-keto-4-(4-methylpiperazin-4-ium-1-yl)butyl]-N-(p-tolyl)methanesulfonamide Formula: C17H28N3O3S+ MolecularWeight: 354.48752

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N(CCCC(=O)N2CC[NH+](CC2)C)S(=O)(=O)C

Isomeric SMILES

CC1=CC=C(C=C1)N(CCCC(=O)N2CC[NH+](CC2)C)S(=O)(=O)C

InChI

InChI=1S/C17H27N3O3S/c1-15-6-8-16(9-7-15)20(24(3,22)23)10-4-5-17(21)19-13-11-18(2)12-14-19/h6-9H,4-5,10-14H2,1-3H3/p+1