N-(pyridin-1-ium-3-ylmethyl)-3-(trifluoromethyl)benzamide chloride

Systemtic Name: N-(pyridin-1-ium-3-ylmethyl)-3-(trifluoromethyl)benzamide chloride Openeye Name: N-(pyridin-1-ium-3-ylmethyl)-3-(trifluoromethyl)benzamide chloride CAS Name: N-(3-pyridin-1-iumylmethyl)-3-(trifluoromethyl)benzamide chloride IUPAC Name: N-(pyridin-1-ium-3-ylmethyl)-3-(trifluoromethyl)benzamide chloride Traditional Name: N-(pyridin-1-ium-3-ylmethyl)-3-(trifluoromethyl)benzamide chloride Formula: C14H12ClF3N2O MolecularWeight: 316.70609

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)C(F)(F)F)C(=O)NCC2=C[NH+]=CC=C2.[Cl-]

Isomeric SMILES

C1=CC(=CC(=C1)C(F)(F)F)C(=O)NCC2=C[NH+]=CC=C2.[Cl-]

InChI

InChI=1S/C14H11F3N2O.ClH/c15-14(16,17)12-5-1-4-11(7-12)13(20)19-9-10-3-2-6-18-8-10;/h1-8H,9H2,(H,19,20);1H