2-(pyridin-1-ium-1-ylmethyl)-1H-benzimidazole bromide hydrobromide

Systemtic Name: 2-(pyridin-1-ium-1-ylmethyl)-1H-benzimidazole bromide hydrobromide Openeye Name: 2-(pyridin-1-ium-1-ylmethyl)-1H-benzimidazole bromide hydrobromide CAS Name: 2-(1-pyridin-1-iumylmethyl)-1H-benzimidazole bromide hydrobromide IUPAC Name: 2-(pyridin-1-ium-1-ylmethyl)-1H-benzimidazole bromide hydrobromide Traditional Name: 2-(pyridin-1-ium-1-ylmethyl)-1H-benzimidazole bromide hydrobromide Formula: C13H13Br2N3 MolecularWeight: 371.07042

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=[N+](C=C1)CC2=NC3=CC=CC=C3N2.Br.[Br-]

Isomeric SMILES

C1=CC=[N+](C=C1)CC2=NC3=CC=CC=C3N2.Br.[Br-]

InChI

InChI=1S/C13H12N3.2BrH/c1-4-8-16(9-5-1)10-13-14-11-6-2-3-7-12(11)15-13;;/h1-9H,10H2,(H,14,15);2*1H/q+1;;/p-1