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

Systemtic Name: 2-tert-butyl-4-(2-piperidin-1-ium-1-ylethyl)-3H-imidazo[1,2-a]benzimidazol-4-ium dichloride Openeye Name: 2-tert-butyl-4-(2-piperidin-1-ium-1-ylethyl)-3H-imidazo[1,2-a]benzimidazol-4-ium dichloride CAS Name: 2-tert-butyl-4-[2-(1-piperidin-1-iumyl)ethyl]-3H-imidazo[1,2-a]benzimidazol-4-ium dichloride IUPAC Name: 2-tert-butyl-4-(2-piperidin-1-ium-1-ylethyl)-3H-imidazo[1,2-a]benzimidazol-4-ium dichloride Traditional Name: 2-tert-butyl-4-(2-piperidin-1-ium-1-ylethyl)-3H-imidazo[1,2-a]benzimidazol-4-ium dichloride Formula: C20H30Cl2N4 MolecularWeight: 397.385

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CN2C3=CC=CC=C3[N+](=C2N1)CC[NH+]4CCCCC4.[Cl-].[Cl-]

Isomeric SMILES

CC(C)(C)C1=CN2C3=CC=CC=C3[N+](=C2N1)CC[NH+]4CCCCC4.[Cl-].[Cl-]

InChI

InChI=1S/C20H28N4.2ClH/c1-20(2,3)18-15-24-17-10-6-5-9-16(17)23(19(24)21-18)14-13-22-11-7-4-8-12-22;;/h5-6,9-10,15H,4,7-8,11-14H2,1-3H3;2*1H