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

Systemtic Name: N-[(2-ethoxyphenyl)methyl]-3-(2-piperidin-1-ium-1-ylethyl)-1H-benzimidazol-3-ium-2-amine Openeye Name: N-[(2-ethoxyphenyl)methyl]-3-(2-piperidin-1-ium-1-ylethyl)-1H-benzimidazol-3-ium-2-amine CAS Name: N-[(2-ethoxyphenyl)methyl]-3-[2-(1-piperidin-1-iumyl)ethyl]-1H-benzimidazol-3-ium-2-amine IUPAC Name: N-[(2-ethoxyphenyl)methyl]-3-(2-piperidin-1-ium-1-ylethyl)-1H-benzimidazol-3-ium-2-amine Traditional Name: (2-ethoxybenzyl)-[3-(2-piperidin-1-ium-1-ylethyl)-1H-benzimidazol-3-ium-2-yl]amine Formula: C23H32N4O+2 MolecularWeight: 380.52638

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H30N4O/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)/p+2