N-[(4-ethoxyphenyl)methyl]-3-(2-morpholin-4-ium-4-ylethyl)-1H-benzimidazol-3-ium-2-amine dichloride

Systemtic Name: N-[(4-ethoxyphenyl)methyl]-3-(2-morpholin-4-ium-4-ylethyl)-1H-benzimidazol-3-ium-2-amine dichloride Openeye Name: N-[(4-ethoxyphenyl)methyl]-3-(2-morpholin-4-ium-4-ylethyl)-1H-benzimidazol-3-ium-2-amine dichloride CAS Name: N-[(4-ethoxyphenyl)methyl]-3-[2-(4-morpholin-4-iumyl)ethyl]-1H-benzimidazol-3-ium-2-amine dichloride IUPAC Name: N-[(4-ethoxyphenyl)methyl]-3-(2-morpholin-4-ium-4-ylethyl)-1H-benzimidazol-3-ium-2-amine dichloride Traditional Name: (4-ethoxybenzyl)-[3-(2-morpholin-4-ium-4-ylethyl)-1H-benzimidazol-3-ium-2-yl]amine dichloride Formula: C22H30Cl2N4O2 MolecularWeight: 453.4052

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)CNC2=[N+](C3=CC=CC=C3N2)CC[NH+]4CCOCC4.[Cl-].[Cl-]

Isomeric SMILES

CCOC1=CC=C(C=C1)CNC2=[N+](C3=CC=CC=C3N2)CC[NH+]4CCOCC4.[Cl-].[Cl-]

InChI

InChI=1S/C22H28N4O2.2ClH/c1-2-28-19-9-7-18(8-10-19)17-23-22-24-20-5-3-4-6-21(20)26(22)12-11-25-13-15-27-16-14-25;;/h3-10H,2,11-17H2,1H3,(H,23,24);2*1H