ethenyl 3-cyano-3-(5-phenylpyridin-3-yl)-8-azabicyclo[3.2.1]octane-8-carboxylate

Systemtic Name: ethenyl 3-cyano-3-(5-phenylpyridin-3-yl)-8-azabicyclo[3.2.1]octane-8-carboxylate Openeye Name: vinyl 3-cyano-3-(5-phenyl-3-pyridyl)-8-azabicyclo[3.2.1]octane-8-carboxylate CAS Name: 3-cyano-3-(5-phenyl-3-pyridinyl)-8-azabicyclo[3.2.1]octane-8-carboxylic acid ethenyl ester IUPAC Name: ethenyl 3-cyano-3-(5-phenylpyridin-3-yl)-8-azabicyclo[3.2.1]octane-8-carboxylate Traditional Name: 3-cyano-3-(5-phenyl-3-pyridyl)-8-azabicyclo[3.2.1]octane-8-carboxylic acid vinyl ester Formula: C22H21N3O2 MolecularWeight: 359.42104

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Descriptors Computed from Structure

Canonical SMILES:

C=COC(=O)N1C2CCC1CC(C2)(C#N)C3=CN=CC(=C3)C4=CC=CC=C4

Isomeric SMILES

C=COC(=O)N1C2CCC1CC(C2)(C#N)C3=CN=CC(=C3)C4=CC=CC=C4

InChI

InChI=1S/C22H21N3O2/c1-2-27-21(26)25-19-8-9-20(25)12-22(11-19,15-23)18-10-17(13-24-14-18)16-6-4-3-5-7-16/h2-7,10,13-14,19-20H,1,8-9,11-12H2