N-[(2-ethoxyphenyl)methyl]-3-(2-piperidin-1-ium-1-ylethyl)-1H-benzimidazol-3-ium-2-amine dichloride

Systemtic Name: N-[(2-ethoxyphenyl)methyl]-3-(2-piperidin-1-ium-1-ylethyl)-1H-benzimidazol-3-ium-2-amine dichloride Openeye Name: N-[(2-ethoxyphenyl)methyl]-3-(2-piperidin-1-ium-1-ylethyl)-1H-benzimidazol-3-ium-2-amine dichloride CAS Name: N-[(2-ethoxyphenyl)methyl]-3-[2-(1-piperidin-1-iumyl)ethyl]-1H-benzimidazol-3-ium-2-amine dichloride IUPAC Name: N-[(2-ethoxyphenyl)methyl]-3-(2-piperidin-1-ium-1-ylethyl)-1H-benzimidazol-3-ium-2-amine dichloride Traditional Name: (2-ethoxybenzyl)-[3-(2-piperidin-1-ium-1-ylethyl)-1H-benzimidazol-3-ium-2-yl]amine dichloride Formula: C23H32Cl2N4O MolecularWeight: 451.43238

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1CNC2=[N+](C3=CC=CC=C3N2)CC[NH+]4CCCCC4.[Cl-].[Cl-]

Isomeric SMILES

CCOC1=CC=CC=C1CNC2=[N+](C3=CC=CC=C3N2)CC[NH+]4CCCCC4.[Cl-].[Cl-]

InChI

InChI=1S/C23H30N4O.2ClH/c1-2-28-22-13-7-4-10-19(22)18-24-23-25-20-11-5-6-12-21(20)27(23)17-16-26-14-8-3-9-15-26;;/h4-7,10-13H,2-3,8-9,14-18H2,1H3,(H,24,25);2*1H