N-(1H-benzimidazol-2-yl)-1-(1-methylpyridin-1-ium-4-yl)methanimine tetrafluoroborate

Systemtic Name: N-(1H-benzimidazol-2-yl)-1-(1-methylpyridin-1-ium-4-yl)methanimine tetrafluoroborate Openeye Name: N-(1H-benzimidazol-2-yl)-1-(1-methylpyridin-1-ium-4-yl)methanimine tetrafluoroborate CAS Name: N-(1H-benzimidazol-2-yl)-1-(1-methyl-4-pyridin-1-iumyl)methanimine tetrafluoroborate IUPAC Name: N-(1H-benzimidazol-2-yl)-1-(1-methylpyridin-1-ium-4-yl)methanimine tetrafluoroborate Traditional Name: (E)-1H-benzimidazol-2-yl-[(1-methylpyridin-1-ium-4-yl)methylene]amine tetrafluoroborate Formula: C14H13BF4N4 MolecularWeight: 324.084433

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Descriptors Computed from Structure

Canonical SMILES:

[B-](F)(F)(F)F.C[N+]1=CC=C(C=C1)C=NC2=NC3=CC=CC=C3N2

Isomeric SMILES

[B-](F)(F)(F)F.C[N+]1=CC=C(C=C1)/C=N/C2=NC3=CC=CC=C3N2

InChI

InChI=1S/C14H12N4.BF4/c1-18-8-6-11(7-9-18)10-15-14-16-12-4-2-3-5-13(12)17-14;2-1(3,4)5/h2-10H,1H3;/q;-1/p+1