2,3,5,6-tetramethyl-N-[[4-(4-methylpiperazin-4-ium-1-yl)carbonylphenyl]methyl]benzenesulfonamide

Systemtic Name: 2,3,5,6-tetramethyl-N-[[4-(4-methylpiperazin-4-ium-1-yl)carbonylphenyl]methyl]benzenesulfonamide Openeye Name: 2,3,5,6-tetramethyl-N-[[4-(4-methylpiperazin-4-ium-1-carbonyl)phenyl]methyl]benzenesulfonamide CAS Name: 2,3,5,6-tetramethyl-N-[[4-[(4-methyl-1-piperazin-4-iumyl)-oxomethyl]phenyl]methyl]benzenesulfonamide IUPAC Name: 2,3,5,6-tetramethyl-N-[[4-(4-methylpiperazin-4-ium-1-carbonyl)phenyl]methyl]benzenesulfonamide Traditional Name: 2,3,5,6-tetramethyl-N-[4-(4-methylpiperazin-4-ium-1-carbonyl)benzyl]benzenesulfonamide Formula: C23H32N3O3S+ MolecularWeight: 430.58348

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1C)S(=O)(=O)NCC2=CC=C(C=C2)C(=O)N3CC[NH+](CC3)C)C)C

Isomeric SMILES

CC1=CC(=C(C(=C1C)S(=O)(=O)NCC2=CC=C(C=C2)C(=O)N3CC[NH+](CC3)C)C)C

InChI

InChI=1S/C23H31N3O3S/c1-16-14-17(2)19(4)22(18(16)3)30(28,29)24-15-20-6-8-21(9-7-20)23(27)26-12-10-25(5)11-13-26/h6-9,14,24H,10-13,15H2,1-5H3/p+1