N-[2-(4-ethylpiperazin-4-ium-1-yl)phenyl]-4-(trifluoromethyloxy)benzenesulfonamide

Systemtic Name: N-[2-(4-ethylpiperazin-4-ium-1-yl)phenyl]-4-(trifluoromethyloxy)benzenesulfonamide Openeye Name: N-[2-(4-ethylpiperazin-4-ium-1-yl)phenyl]-4-(trifluoromethoxy)benzenesulfonamide CAS Name: N-[2-(4-ethyl-1-piperazin-4-iumyl)phenyl]-4-(trifluoromethoxy)benzenesulfonamide IUPAC Name: N-[2-(4-ethylpiperazin-4-ium-1-yl)phenyl]-4-(trifluoromethoxy)benzenesulfonamide Traditional Name: N-[2-(4-ethylpiperazin-4-ium-1-yl)phenyl]-4-(trifluoromethoxy)benzenesulfonamide Formula: C19H23F3N3O3S+ MolecularWeight: 430.46443

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCN(CC1)C2=CC=CC=C2NS(=O)(=O)C3=CC=C(C=C3)OC(F)(F)F

Isomeric SMILES

CC[NH+]1CCN(CC1)C2=CC=CC=C2NS(=O)(=O)C3=CC=C(C=C3)OC(F)(F)F

InChI

InChI=1S/C19H22F3N3O3S/c1-2-24-11-13-25(14-12-24)18-6-4-3-5-17(18)23-29(26,27)16-9-7-15(8-10-16)28-19(20,21)22/h3-10,23H,2,11-14H2,1H3/p+1