2-[2-(1H-benzimidazol-2-ylamino)-1-(pyridin-2-ylmethyl)piperidin-1-ium-1-yl]ethanol

Systemtic Name: 2-[2-(1H-benzimidazol-2-ylamino)-1-(pyridin-2-ylmethyl)piperidin-1-ium-1-yl]ethanol Openeye Name: 2-[2-(1H-benzimidazol-2-ylamino)-1-(2-pyridylmethyl)piperidin-1-ium-1-yl]ethanol CAS Name: 2-[2-(1H-benzimidazol-2-ylamino)-1-(2-pyridinylmethyl)-1-piperidin-1-iumyl]ethanol IUPAC Name: 2-[2-(1H-benzimidazol-2-ylamino)-1-(pyridin-2-ylmethyl)piperidin-1-ium-1-yl]ethanol Traditional Name: 2-[2-(1H-benzimidazol-2-ylamino)-1-(2-pyridylmethyl)piperidin-1-ium-1-yl]ethanol Formula: C20H26N5O+ MolecularWeight: 352.45334

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[N+](C(C1)NC2=NC3=CC=CC=C3N2)(CCO)CC4=CC=CC=N4

Isomeric SMILES

C1CC[N+](C(C1)NC2=NC3=CC=CC=C3N2)(CCO)CC4=CC=CC=N4

InChI

InChI=1S/C20H26N5O/c26-14-13-25(15-16-7-3-5-11-21-16)12-6-4-10-19(25)24-20-22-17-8-1-2-9-18(17)23-20/h1-3,5,7-9,11,19,26H,4,6,10,12-15H2,(H2,22,23,24)/q+1