N-[(4-phenylmethoxyphenyl)methyl]-1-(2-piperidin-1-ium-1-ylethyl)benzimidazol-2-amine

Systemtic Name: N-[(4-phenylmethoxyphenyl)methyl]-1-(2-piperidin-1-ium-1-ylethyl)benzimidazol-2-amine Openeye Name: N-[(4-benzyloxyphenyl)methyl]-1-(2-piperidin-1-ium-1-ylethyl)benzimidazol-2-amine CAS Name: N-[(4-phenylmethoxyphenyl)methyl]-1-[2-(1-piperidin-1-iumyl)ethyl]-2-benzimidazolamine IUPAC Name: N-[(4-phenylmethoxyphenyl)methyl]-1-(2-piperidin-1-ium-1-ylethyl)benzimidazol-2-amine Traditional Name: (4-benzoxybenzyl)-[1-(2-piperidin-1-ium-1-ylethyl)benzimidazol-2-yl]amine Formula: C28H33N4O+ MolecularWeight: 441.58782

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](CC1)CCN2C3=CC=CC=C3N=C2NCC4=CC=C(C=C4)OCC5=CC=CC=C5

Isomeric SMILES

C1CC[NH+](CC1)CCN2C3=CC=CC=C3N=C2NCC4=CC=C(C=C4)OCC5=CC=CC=C5

InChI

InChI=1S/C28H32N4O/c1-3-9-24(10-4-1)22-33-25-15-13-23(14-16-25)21-29-28-30-26-11-5-6-12-27(26)32(28)20-19-31-17-7-2-8-18-31/h1,3-6,9-16H,2,7-8,17-22H2,(H,29,30)/p+1