2-[(1,3-dimethyl-4,5-dihydroimidazol-1-ium-2-yl)methyl]-1H-benzimidazole

Systemtic Name: 2-[(1,3-dimethyl-4,5-dihydroimidazol-1-ium-2-yl)methyl]-1H-benzimidazole Openeye Name: 2-[(1,3-dimethyl-4,5-dihydroimidazol-1-ium-2-yl)methyl]-1H-benzimidazole CAS Name: 2-[(1,3-dimethyl-4,5-dihydroimidazol-1-ium-2-yl)methyl]-1H-benzimidazole IUPAC Name: 2-[(1,3-dimethyl-4,5-dihydroimidazol-1-ium-2-yl)methyl]-1H-benzimidazole Traditional Name: 2-[(1,3-dimethyl-2-imidazolin-1-ium-2-yl)methyl]-1H-benzimidazole Formula: C13H17N4+ MolecularWeight: 229.30088

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1CC[N+](=C1CC2=NC3=CC=CC=C3N2)C

Isomeric SMILES

CN1CC[N+](=C1CC2=NC3=CC=CC=C3N2)C

InChI

InChI=1S/C13H17N4/c1-16-7-8-17(2)13(16)9-12-14-10-5-3-4-6-11(10)15-12/h3-6H,7-9H2,1-2H3,(H,14,15)/q+1