4-methyl-N-(4-methylphenyl)-3-[4-(2-oxidanylidene-2-piperidin-1-yl-ethyl)piperazin-4-ium-1-yl]carbonyl-benzenesulfonamide

Systemtic Name: 4-methyl-N-(4-methylphenyl)-3-[4-(2-oxidanylidene-2-piperidin-1-yl-ethyl)piperazin-4-ium-1-yl]carbonyl-benzenesulfonamide Openeye Name: 4-methyl-3-[4-[2-oxo-2-(1-piperidyl)ethyl]piperazin-4-ium-1-carbonyl]-N-(p-tolyl)benzenesulfonamide CAS Name: 4-methyl-N-(4-methylphenyl)-3-[oxo-[4-[2-oxo-2-(1-piperidinyl)ethyl]-1-piperazin-4-iumyl]methyl]benzenesulfonamide IUPAC Name: 4-methyl-N-(4-methylphenyl)-3-[4-(2-oxo-2-piperidin-1-ylethyl)piperazin-4-ium-1-carbonyl]benzenesulfonamide Traditional Name: 3-[4-(2-keto-2-piperidino-ethyl)piperazin-4-ium-1-carbonyl]-4-methyl-N-(p-tolyl)benzenesulfonamide Formula: C26H35N4O4S+ MolecularWeight: 499.6455

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NS(=O)(=O)C2=CC(=C(C=C2)C)C(=O)N3CC[NH+](CC3)CC(=O)N4CCCCC4

Isomeric SMILES

CC1=CC=C(C=C1)NS(=O)(=O)C2=CC(=C(C=C2)C)C(=O)N3CC[NH+](CC3)CC(=O)N4CCCCC4

InChI

InChI=1S/C26H34N4O4S/c1-20-6-9-22(10-7-20)27-35(33,34)23-11-8-21(2)24(18-23)26(32)30-16-14-28(15-17-30)19-25(31)29-12-4-3-5-13-29/h6-11,18,27H,3-5,12-17,19H2,1-2H3/p+1