2-[1-phenyl-2-(pyridin-4-ylmethoxy)pyrrolidin-1-ium-1-yl]ethanamide

Systemtic Name: 2-[1-phenyl-2-(pyridin-4-ylmethoxy)pyrrolidin-1-ium-1-yl]ethanamide Openeye Name: 2-[1-phenyl-2-(4-pyridylmethoxy)pyrrolidin-1-ium-1-yl]acetamide CAS Name: 2-[1-phenyl-2-(pyridin-4-ylmethoxy)-1-pyrrolidin-1-iumyl]acetamide IUPAC Name: 2-[1-phenyl-2-(pyridin-4-ylmethoxy)pyrrolidin-1-ium-1-yl]acetamide Traditional Name: 2-[1-phenyl-2-(4-pyridylmethoxy)pyrrolidin-1-ium-1-yl]acetamide Formula: C18H22N3O2+ MolecularWeight: 312.38618

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Descriptors Computed from Structure

Canonical SMILES:

C1CC([N+](C1)(CC(=O)N)C2=CC=CC=C2)OCC3=CC=NC=C3

Isomeric SMILES

C1CC([N+](C1)(CC(=O)N)C2=CC=CC=C2)OCC3=CC=NC=C3

InChI

InChI=1S/C18H21N3O2/c19-17(22)13-21(16-5-2-1-3-6-16)12-4-7-18(21)23-14-15-8-10-20-11-9-15/h1-3,5-6,8-11,18H,4,7,12-14H2,(H-,19,22)/p+1