2,4,6-trimethyl-N-[2-(4-methylpiperazin-4-ium-1-yl)-2-oxidanylidene-ethyl]-N-(phenylmethyl)benzenesulfonamide

Systemtic Name: 2,4,6-trimethyl-N-[2-(4-methylpiperazin-4-ium-1-yl)-2-oxidanylidene-ethyl]-N-(phenylmethyl)benzenesulfonamide Openeye Name: N-benzyl-2,4,6-trimethyl-N-[2-(4-methylpiperazin-4-ium-1-yl)-2-oxo-ethyl]benzenesulfonamide CAS Name: 2,4,6-trimethyl-N-[2-(4-methyl-1-piperazin-4-iumyl)-2-oxoethyl]-N-(phenylmethyl)benzenesulfonamide IUPAC Name: N-benzyl-2,4,6-trimethyl-N-[2-(4-methylpiperazin-4-ium-1-yl)-2-oxoethyl]benzenesulfonamide Traditional Name: N-benzyl-N-[2-keto-2-(4-methylpiperazin-4-ium-1-yl)ethyl]-2,4,6-trimethyl-benzenesulfonamide Formula: C23H32N3O3S+ MolecularWeight: 430.58348

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)C)S(=O)(=O)N(CC2=CC=CC=C2)CC(=O)N3CC[NH+](CC3)C)C

Isomeric SMILES

CC1=CC(=C(C(=C1)C)S(=O)(=O)N(CC2=CC=CC=C2)CC(=O)N3CC[NH+](CC3)C)C

InChI

InChI=1S/C23H31N3O3S/c1-18-14-19(2)23(20(3)15-18)30(28,29)26(16-21-8-6-5-7-9-21)17-22(27)25-12-10-24(4)11-13-25/h5-9,14-15H,10-13,16-17H2,1-4H3/p+1