3-(2-piperidin-1-ylethyl)-N-(pyridin-4-ylmethyl)-1H-benzimidazol-3-ium-2-amine

Systemtic Name: 3-(2-piperidin-1-ylethyl)-N-(pyridin-4-ylmethyl)-1H-benzimidazol-3-ium-2-amine Openeye Name: 3-[2-(1-piperidyl)ethyl]-N-(4-pyridylmethyl)-1H-benzimidazol-3-ium-2-amine CAS Name: 3-[2-(1-piperidinyl)ethyl]-N-(pyridin-4-ylmethyl)-1H-benzimidazol-3-ium-2-amine IUPAC Name: 3-(2-piperidin-1-ylethyl)-N-(pyridin-4-ylmethyl)-1H-benzimidazol-3-ium-2-amine Traditional Name: [3-(2-piperidinoethyl)-1H-benzimidazol-3-ium-2-yl]-(4-pyridylmethyl)amine Formula: C20H26N5+ MolecularWeight: 336.45394

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)CC[N+]2=C(NC3=CC=CC=C32)NCC4=CC=NC=C4

Isomeric SMILES

C1CCN(CC1)CC[N+]2=C(NC3=CC=CC=C32)NCC4=CC=NC=C4

InChI

InChI=1S/C20H25N5/c1-4-12-24(13-5-1)14-15-25-19-7-3-2-6-18(19)23-20(25)22-16-17-8-10-21-11-9-17/h2-3,6-11H,1,4-5,12-16H2,(H,22,23)/p+1