2-(1-azoniabicyclo[2.2.2]octan-3-yl)-1-phenyl-2-pyridin-2-yl-ethanone chloride

Systemtic Name: 2-(1-azoniabicyclo[2.2.2]octan-3-yl)-1-phenyl-2-pyridin-2-yl-ethanone chloride Openeye Name: 1-phenyl-2-(2-pyridyl)-2-quinuclidin-1-ium-3-yl-ethanone chloride CAS Name: 2-(1-azoniabicyclo[2.2.2]octan-3-yl)-1-phenyl-2-(2-pyridinyl)ethanone chloride IUPAC Name: 2-(1-azoniabicyclo[2.2.2]octan-3-yl)-1-phenyl-2-pyridin-2-ylethanone chloride Traditional Name: 1-phenyl-2-(2-pyridyl)-2-quinuclidin-1-ium-3-yl-ethanone chloride Formula: C20H23ClN2O MolecularWeight: 342.86242

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+]2CCC1C(C2)C(C3=CC=CC=N3)C(=O)C4=CC=CC=C4.[Cl-]

Isomeric SMILES

C1C[NH+]2CCC1C(C2)C(C3=CC=CC=N3)C(=O)C4=CC=CC=C4.[Cl-]

InChI

InChI=1S/C20H22N2O.ClH/c23-20(16-6-2-1-3-7-16)19(18-8-4-5-11-21-18)17-14-22-12-9-15(17)10-13-22;/h1-8,11,15,17,19H,9-10,12-14H2;1H