N-[2-(4-methylpiperazin-4-ium-1-yl)-2-oxidanylidene-ethyl]-N-[3-(trifluoromethyl)phenyl]benzenesulfonamide

Systemtic Name: N-[2-(4-methylpiperazin-4-ium-1-yl)-2-oxidanylidene-ethyl]-N-[3-(trifluoromethyl)phenyl]benzenesulfonamide Openeye Name: N-[2-(4-methylpiperazin-4-ium-1-yl)-2-oxo-ethyl]-N-[3-(trifluoromethyl)phenyl]benzenesulfonamide CAS Name: N-[2-(4-methyl-1-piperazin-4-iumyl)-2-oxoethyl]-N-[3-(trifluoromethyl)phenyl]benzenesulfonamide IUPAC Name: N-[2-(4-methylpiperazin-4-ium-1-yl)-2-oxoethyl]-N-[3-(trifluoromethyl)phenyl]benzenesulfonamide Traditional Name: N-[2-keto-2-(4-methylpiperazin-4-ium-1-yl)ethyl]-N-[3-(trifluoromethyl)phenyl]benzenesulfonamide Formula: C20H23F3N3O3S+ MolecularWeight: 442.47513

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)C(=O)CN(C2=CC=CC(=C2)C(F)(F)F)S(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

C[NH+]1CCN(CC1)C(=O)CN(C2=CC=CC(=C2)C(F)(F)F)S(=O)(=O)C3=CC=CC=C3

InChI

InChI=1S/C20H22F3N3O3S/c1-24-10-12-25(13-11-24)19(27)15-26(30(28,29)18-8-3-2-4-9-18)17-7-5-6-16(14-17)20(21,22)23/h2-9,14H,10-13,15H2,1H3/p+1