3-cyano-N-[2-(pyridin-3-ylmethyl)-1-azabicyclo[2.2.2]octan-3-yl]benzamide

Systemtic Name: 3-cyano-N-[2-(pyridin-3-ylmethyl)-1-azabicyclo[2.2.2]octan-3-yl]benzamide Openeye Name: 3-cyano-N-[2-(3-pyridylmethyl)quinuclidin-3-yl]benzamide CAS Name: 3-cyano-N-[2-(3-pyridinylmethyl)-1-azabicyclo[2.2.2]octan-3-yl]benzamide IUPAC Name: 3-cyano-N-[2-(pyridin-3-ylmethyl)-1-azabicyclo[2.2.2]octan-3-yl]benzamide Traditional Name: 3-cyano-N-[2-(3-pyridylmethyl)quinuclidin-3-yl]benzamide Formula: C21H22N4O MolecularWeight: 346.42558

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Descriptors Computed from Structure

Canonical SMILES:

C1CN2CCC1C(C2CC3=CN=CC=C3)NC(=O)C4=CC=CC(=C4)C#N

Isomeric SMILES

C1CN2CCC1C(C2CC3=CN=CC=C3)NC(=O)C4=CC=CC(=C4)C#N

InChI

InChI=1S/C21H22N4O/c22-13-15-3-1-5-18(11-15)21(26)24-20-17-6-9-25(10-7-17)19(20)12-16-4-2-8-23-14-16/h1-5,8,11,14,17,19-20H,6-7,9-10,12H2,(H,24,26)