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

Systemtic Name: 4-methyl-N-[[4-(4-methylpiperazin-4-ium-1-yl)carbonylcyclohexyl]methyl]benzenesulfonamide Openeye Name: 4-methyl-N-[[4-(4-methylpiperazin-4-ium-1-carbonyl)cyclohexyl]methyl]benzenesulfonamide CAS Name: 4-methyl-N-[[4-[(4-methyl-1-piperazin-4-iumyl)-oxomethyl]cyclohexyl]methyl]benzenesulfonamide IUPAC Name: 4-methyl-N-[[4-(4-methylpiperazin-4-ium-1-carbonyl)cyclohexyl]methyl]benzenesulfonamide Traditional Name: 4-methyl-N-[[4-(4-methylpiperazin-4-ium-1-carbonyl)cyclohexyl]methyl]benzenesulfonamide Formula: C20H32N3O3S+ MolecularWeight: 394.55138

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NCC2CCC(CC2)C(=O)N3CC[NH+](CC3)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NCC2CCC(CC2)C(=O)N3CC[NH+](CC3)C

InChI

InChI=1S/C20H31N3O3S/c1-16-3-9-19(10-4-16)27(25,26)21-15-17-5-7-18(8-6-17)20(24)23-13-11-22(2)12-14-23/h3-4,9-10,17-18,21H,5-8,11-15H2,1-2H3/p+1