5,6-dimethyl-2-[(3-methylimidazol-3-ium-1-yl)methyl]-1H-benzimidazole chloride

Systemtic Name: 5,6-dimethyl-2-[(3-methylimidazol-3-ium-1-yl)methyl]-1H-benzimidazole chloride Openeye Name: 5,6-dimethyl-2-[(3-methylimidazol-3-ium-1-yl)methyl]-1H-benzimidazole chloride CAS Name: 5,6-dimethyl-2-[(3-methyl-1-imidazol-3-iumyl)methyl]-1H-benzimidazole chloride IUPAC Name: 5,6-dimethyl-2-[(3-methylimidazol-3-ium-1-yl)methyl]-1H-benzimidazole chloride Traditional Name: 5,6-dimethyl-2-[(3-methylimidazol-3-ium-1-yl)methyl]-1H-benzimidazole chloride Formula: C14H17ClN4 MolecularWeight: 276.76458

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1C)N=C(N2)CN3C=C[N+](=C3)C.[Cl-]

Isomeric SMILES

CC1=CC2=C(C=C1C)N=C(N2)CN3C=C[N+](=C3)C.[Cl-]

InChI

InChI=1S/C14H17N4.ClH/c1-10-6-12-13(7-11(10)2)16-14(15-12)8-18-5-4-17(3)9-18;/h4-7,9H,8H2,1-3H3,(H,15,16);1H/q+1;/p-1