2,3,4,5,6-pentamethyl-N-[4-(4-methylpiperazin-4-ium-1-yl)phenyl]benzenesulfonamide

Systemtic Name: 2,3,4,5,6-pentamethyl-N-[4-(4-methylpiperazin-4-ium-1-yl)phenyl]benzenesulfonamide Openeye Name: 2,3,4,5,6-pentamethyl-N-[4-(4-methylpiperazin-4-ium-1-yl)phenyl]benzenesulfonamide CAS Name: 2,3,4,5,6-pentamethyl-N-[4-(4-methyl-1-piperazin-4-iumyl)phenyl]benzenesulfonamide IUPAC Name: 2,3,4,5,6-pentamethyl-N-[4-(4-methylpiperazin-4-ium-1-yl)phenyl]benzenesulfonamide Traditional Name: 2,3,4,5,6-pentamethyl-N-[4-(4-methylpiperazin-4-ium-1-yl)phenyl]benzenesulfonamide Formula: C22H32N3O2S+ MolecularWeight: 402.57338

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(C(=C1C)C)S(=O)(=O)NC2=CC=C(C=C2)N3CC[NH+](CC3)C)C)C

Isomeric SMILES

CC1=C(C(=C(C(=C1C)C)S(=O)(=O)NC2=CC=C(C=C2)N3CC[NH+](CC3)C)C)C

InChI

InChI=1S/C22H31N3O2S/c1-15-16(2)18(4)22(19(5)17(15)3)28(26,27)23-20-7-9-21(10-8-20)25-13-11-24(6)12-14-25/h7-10,23H,11-14H2,1-6H3/p+1