2-pyridin-2-yl-4-(trifluoromethyl)-1H-benzimidazol-3-ium chloride

Systemtic Name: 2-pyridin-2-yl-4-(trifluoromethyl)-1H-benzimidazol-3-ium chloride Openeye Name: 2-(2-pyridyl)-4-(trifluoromethyl)-1H-benzimidazol-3-ium chloride CAS Name: 2-(2-pyridinyl)-4-(trifluoromethyl)-1H-benzimidazol-3-ium chloride IUPAC Name: 2-pyridin-2-yl-4-(trifluoromethyl)-1H-benzimidazol-3-ium chloride Traditional Name: 2-(2-pyridyl)-4-(trifluoromethyl)-1H-benzimidazol-3-ium chloride Formula: C13H9ClF3N3 MolecularWeight: 299.67887

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=NC(=C1)C2=[NH+]C3=C(C=CC=C3N2)C(F)(F)F.[Cl-]

Isomeric SMILES

C1=CC=NC(=C1)C2=[NH+]C3=C(C=CC=C3N2)C(F)(F)F.[Cl-]

InChI

InChI=1S/C13H8F3N3.ClH/c14-13(15,16)8-4-3-6-9-11(8)19-12(18-9)10-5-1-2-7-17-10;/h1-7H,(H,18,19);1H