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

Systemtic Name: N-(3-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-(m-tolyl)methanesulfonamide CAS Name: N-(3-methylphenyl)-N-[4-(4-methyl-1-piperazin-4-iumyl)-4-oxobutyl]methanesulfonamide IUPAC Name: N-(3-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-(m-tolyl)methanesulfonamide Formula: C17H28N3O3S+ MolecularWeight: 354.48752

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H27N3O3S/c1-15-6-4-7-16(14-15)20(24(3,22)23)9-5-8-17(21)19-12-10-18(2)11-13-19/h4,6-7,14H,5,8-13H2,1-3H3/p+1