3-(2-azanyl-3H-benzimidazol-1-ium-1-yl)propyl-dimethyl-azanium dichloride

Systemtic Name: 3-(2-azanyl-3H-benzimidazol-1-ium-1-yl)propyl-dimethyl-azanium dichloride Openeye Name: 3-(2-amino-3H-benzimidazol-1-ium-1-yl)propyl-dimethyl-ammonium dichloride CAS Name: 3-(2-amino-3H-benzimidazol-1-ium-1-yl)propyl-dimethylammonium dichloride IUPAC Name: 3-(2-amino-3H-benzimidazol-1-ium-1-yl)propyl-dimethylazanium dichloride Traditional Name: 3-(2-amino-3H-benzimidazol-1-ium-1-yl)propyl-dimethyl-ammonium dichloride Formula: C12H20Cl2N4 MolecularWeight: 291.22

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)CCC[N+]1=C(NC2=CC=CC=C21)N.[Cl-].[Cl-]

Isomeric SMILES

C[NH+](C)CCC[N+]1=C(NC2=CC=CC=C21)N.[Cl-].[Cl-]

InChI

InChI=1S/C12H18N4.2ClH/c1-15(2)8-5-9-16-11-7-4-3-6-10(11)14-12(16)13;;/h3-4,6-7H,5,8-9H2,1-2H3,(H2,13,14);2*1H