2-phenyl-4-(2-piperidin-1-ium-1-ylethyl)-3H-imidazo[1,2-a]benzimidazol-4-ium dichloride

Systemtic Name: 2-phenyl-4-(2-piperidin-1-ium-1-ylethyl)-3H-imidazo[1,2-a]benzimidazol-4-ium dichloride Openeye Name: 2-phenyl-4-(2-piperidin-1-ium-1-ylethyl)-3H-imidazo[1,2-a]benzimidazol-4-ium dichloride CAS Name: 2-phenyl-4-[2-(1-piperidin-1-iumyl)ethyl]-3H-imidazo[1,2-a]benzimidazol-4-ium dichloride IUPAC Name: 2-phenyl-4-(2-piperidin-1-ium-1-ylethyl)-3H-imidazo[1,2-a]benzimidazol-4-ium dichloride Traditional Name: 2-phenyl-4-(2-piperidin-1-ium-1-ylethyl)-3H-imidazo[1,2-a]benzimidazol-4-ium dichloride Formula: C22H26Cl2N4 MolecularWeight: 417.37464

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](CC1)CC[N+]2=C3NC(=CN3C4=CC=CC=C42)C5=CC=CC=C5.[Cl-].[Cl-]

Isomeric SMILES

C1CC[NH+](CC1)CC[N+]2=C3NC(=CN3C4=CC=CC=C42)C5=CC=CC=C5.[Cl-].[Cl-]

InChI

InChI=1S/C22H24N4.2ClH/c1-3-9-18(10-4-1)19-17-26-21-12-6-5-11-20(21)25(22(26)23-19)16-15-24-13-7-2-8-14-24;;/h1,3-6,9-12,17H,2,7-8,13-16H2;2*1H