N-[(4-ethoxy-3-methoxy-phenyl)methyl]-1-(2-piperidin-1-ium-1-ylethyl)benzimidazol-2-amine

Systemtic Name: N-[(4-ethoxy-3-methoxy-phenyl)methyl]-1-(2-piperidin-1-ium-1-ylethyl)benzimidazol-2-amine Openeye Name: N-[(4-ethoxy-3-methoxy-phenyl)methyl]-1-(2-piperidin-1-ium-1-ylethyl)benzimidazol-2-amine CAS Name: N-[(4-ethoxy-3-methoxyphenyl)methyl]-1-[2-(1-piperidin-1-iumyl)ethyl]-2-benzimidazolamine IUPAC Name: N-[(4-ethoxy-3-methoxyphenyl)methyl]-1-(2-piperidin-1-ium-1-ylethyl)benzimidazol-2-amine Traditional Name: (4-ethoxy-3-methoxy-benzyl)-[1-(2-piperidin-1-ium-1-ylethyl)benzimidazol-2-yl]amine Formula: C24H33N4O2+ MolecularWeight: 409.54442

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)CNC2=NC3=CC=CC=C3N2CC[NH+]4CCCCC4)OC

Isomeric SMILES

CCOC1=C(C=C(C=C1)CNC2=NC3=CC=CC=C3N2CC[NH+]4CCCCC4)OC

InChI

InChI=1S/C24H32N4O2/c1-3-30-22-12-11-19(17-23(22)29-2)18-25-24-26-20-9-5-6-10-21(20)28(24)16-15-27-13-7-4-8-14-27/h5-6,9-12,17H,3-4,7-8,13-16,18H2,1-2H3,(H,25,26)/p+1