[4-(5-cyanopyridin-3-yl)phenyl] 1,4-diazabicyclo[3.2.2]nonane-4-carboxylate

Systemtic Name: [4-(5-cyanopyridin-3-yl)phenyl] 1,4-diazabicyclo[3.2.2]nonane-4-carboxylate Openeye Name: [4-(5-cyano-3-pyridyl)phenyl] 1,4-diazabicyclo[3.2.2]nonane-4-carboxylate CAS Name: 1,4-diazabicyclo[3.2.2]nonane-4-carboxylic acid [4-(5-cyano-3-pyridinyl)phenyl] ester IUPAC Name: [4-(5-cyanopyridin-3-yl)phenyl] 1,4-diazabicyclo[3.2.2]nonane-4-carboxylate Traditional Name: 1,4-diazabicyclo[3.2.2]nonane-4-carboxylic acid [4-(5-cyano-3-pyridyl)phenyl] ester Formula: C20H20N4O2 MolecularWeight: 348.3984

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Descriptors Computed from Structure

Canonical SMILES:

C1CN2CCC1N(CC2)C(=O)OC3=CC=C(C=C3)C4=CN=CC(=C4)C#N

Isomeric SMILES

C1CN2CCC1N(CC2)C(=O)OC3=CC=C(C=C3)C4=CN=CC(=C4)C#N

InChI

InChI=1S/C20H20N4O2/c21-12-15-11-17(14-22-13-15)16-1-3-19(4-2-16)26-20(25)24-10-9-23-7-5-18(24)6-8-23/h1-4,11,13-14,18H,5-10H2