3-fluoranyl-N-[2-(4-methylpiperazin-4-ium-1-yl)-5-(trifluoromethyl)phenyl]benzamide

Systemtic Name: 3-fluoranyl-N-[2-(4-methylpiperazin-4-ium-1-yl)-5-(trifluoromethyl)phenyl]benzamide Openeye Name: 3-fluoro-N-[2-(4-methylpiperazin-4-ium-1-yl)-5-(trifluoromethyl)phenyl]benzamide CAS Name: 3-fluoro-N-[2-(4-methyl-1-piperazin-4-iumyl)-5-(trifluoromethyl)phenyl]benzamide IUPAC Name: 3-fluoro-N-[2-(4-methylpiperazin-4-ium-1-yl)-5-(trifluoromethyl)phenyl]benzamide Traditional Name: 3-fluoro-N-[2-(4-methylpiperazin-4-ium-1-yl)-5-(trifluoromethyl)phenyl]benzamide Formula: C19H20F4N3O+ MolecularWeight: 382.375213

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H19F4N3O/c1-25-7-9-26(10-8-25)17-6-5-14(19(21,22)23)12-16(17)24-18(27)13-3-2-4-15(20)11-13/h2-6,11-12H,7-10H2,1H3,(H,24,27)/p+1