N-[3-chloranyl-5-(trifluoromethyl)pyridin-1-ium-2-yl]-4-fluoranyl-benzamide chloride

Systemtic Name: N-[3-chloranyl-5-(trifluoromethyl)pyridin-1-ium-2-yl]-4-fluoranyl-benzamide chloride Openeye Name: N-[3-chloro-5-(trifluoromethyl)pyridin-1-ium-2-yl]-4-fluoro-benzamide chloride CAS Name: N-[3-chloro-5-(trifluoromethyl)-2-pyridin-1-iumyl]-4-fluorobenzamide chloride IUPAC Name: N-[3-chloro-5-(trifluoromethyl)pyridin-1-ium-2-yl]-4-fluorobenzamide chloride Traditional Name: N-[3-chloro-5-(trifluoromethyl)pyridin-1-ium-2-yl]-4-fluoro-benzamide chloride Formula: C13H8Cl2F4N2O MolecularWeight: 355.115033

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(=O)NC2=C(C=C(C=[NH+]2)C(F)(F)F)Cl)F.[Cl-]

Isomeric SMILES

C1=CC(=CC=C1C(=O)NC2=C(C=C(C=[NH+]2)C(F)(F)F)Cl)F.[Cl-]

InChI

InChI=1S/C13H7ClF4N2O.ClH/c14-10-5-8(13(16,17)18)6-19-11(10)20-12(21)7-1-3-9(15)4-2-7;/h1-6H,(H,19,20,21);1H