N-[3-methyl-4-(4-methylpiperazin-4-ium-1-yl)phenyl]-3-(trifluoromethyl)benzenesulfonamide

Systemtic Name: N-[3-methyl-4-(4-methylpiperazin-4-ium-1-yl)phenyl]-3-(trifluoromethyl)benzenesulfonamide Openeye Name: N-[3-methyl-4-(4-methylpiperazin-4-ium-1-yl)phenyl]-3-(trifluoromethyl)benzenesulfonamide CAS Name: N-[3-methyl-4-(4-methyl-1-piperazin-4-iumyl)phenyl]-3-(trifluoromethyl)benzenesulfonamide IUPAC Name: N-[3-methyl-4-(4-methylpiperazin-4-ium-1-yl)phenyl]-3-(trifluoromethyl)benzenesulfonamide Traditional Name: N-[3-methyl-4-(4-methylpiperazin-4-ium-1-yl)phenyl]-3-(trifluoromethyl)benzenesulfonamide Formula: C19H23F3N3O2S+ MolecularWeight: 414.46503

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)NS(=O)(=O)C2=CC=CC(=C2)C(F)(F)F)N3CC[NH+](CC3)C

Isomeric SMILES

CC1=C(C=CC(=C1)NS(=O)(=O)C2=CC=CC(=C2)C(F)(F)F)N3CC[NH+](CC3)C

InChI

InChI=1S/C19H22F3N3O2S/c1-14-12-16(6-7-18(14)25-10-8-24(2)9-11-25)23-28(26,27)17-5-3-4-15(13-17)19(20,21)22/h3-7,12-13,23H,8-11H2,1-2H3/p+1