4-methyl-N-[2-[4-(4-methylphenyl)sulfonylpiperazin-1-ium-1-yl]ethyl]benzenesulfonamide

Systemtic Name: 4-methyl-N-[2-[4-(4-methylphenyl)sulfonylpiperazin-1-ium-1-yl]ethyl]benzenesulfonamide Openeye Name: 4-methyl-N-[2-[4-(p-tolylsulfonyl)piperazin-1-ium-1-yl]ethyl]benzenesulfonamide CAS Name: 4-methyl-N-[2-[4-(4-methylphenyl)sulfonyl-1-piperazin-1-iumyl]ethyl]benzenesulfonamide IUPAC Name: 4-methyl-N-[2-[4-(4-methylphenyl)sulfonylpiperazin-1-ium-1-yl]ethyl]benzenesulfonamide Traditional Name: 4-methyl-N-[2-(4-tosylpiperazin-1-ium-1-yl)ethyl]benzenesulfonamide Formula: C20H28N3O4S2+ MolecularWeight: 438.58402

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NCC[NH+]2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NCC[NH+]2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)C

InChI

InChI=1S/C20H27N3O4S2/c1-17-3-7-19(8-4-17)28(24,25)21-11-12-22-13-15-23(16-14-22)29(26,27)20-9-5-18(2)6-10-20/h3-10,21H,11-16H2,1-2H3/p+1