2-[(3-butylimidazol-1-ium-1-yl)methyl]-1H-benzimidazole chloride

Systemtic Name: 2-[(3-butylimidazol-1-ium-1-yl)methyl]-1H-benzimidazole chloride Openeye Name: 2-[(3-butylimidazol-1-ium-1-yl)methyl]-1H-benzimidazole chloride CAS Name: 2-[(3-butyl-1-imidazol-1-iumyl)methyl]-1H-benzimidazole chloride IUPAC Name: 2-[(3-butylimidazol-1-ium-1-yl)methyl]-1H-benzimidazole chloride Traditional Name: 2-[(3-butylimidazol-1-ium-1-yl)methyl]-1H-benzimidazole chloride Formula: C15H19ClN4 MolecularWeight: 290.79116

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C=C[N+](=C1)CC2=NC3=CC=CC=C3N2.[Cl-]

Isomeric SMILES

CCCCN1C=C[N+](=C1)CC2=NC3=CC=CC=C3N2.[Cl-]

InChI

InChI=1S/C15H19N4.ClH/c1-2-3-8-18-9-10-19(12-18)11-15-16-13-6-4-5-7-14(13)17-15;/h4-7,9-10,12H,2-3,8,11H2,1H3,(H,16,17);1H/q+1;/p-1