ethyl 5-[4-(3-oxidanyl-1-azabicyclo[2.2.2]octan-2-yl)phenyl]pyridine-3-carboxylate

Systemtic Name: ethyl 5-[4-(3-oxidanyl-1-azabicyclo[2.2.2]octan-2-yl)phenyl]pyridine-3-carboxylate Openeye Name: ethyl 5-[4-(3-hydroxyquinuclidin-2-yl)phenyl]pyridine-3-carboxylate CAS Name: 5-[4-(3-hydroxy-1-azabicyclo[2.2.2]octan-2-yl)phenyl]-3-pyridinecarboxylic acid ethyl ester IUPAC Name: ethyl 5-[4-(3-hydroxy-1-azabicyclo[2.2.2]octan-2-yl)phenyl]pyridine-3-carboxylate Traditional Name: 5-[4-(3-hydroxyquinuclidin-2-yl)phenyl]nicotinic acid ethyl ester Formula: C21H24N2O3 MolecularWeight: 352.42686

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CN=CC(=C1)C2=CC=C(C=C2)C3C(C4CCN3CC4)O

Isomeric SMILES

CCOC(=O)C1=CN=CC(=C1)C2=CC=C(C=C2)C3C(C4CCN3CC4)O

InChI

InChI=1S/C21H24N2O3/c1-2-26-21(25)18-11-17(12-22-13-18)14-3-5-15(6-4-14)19-20(24)16-7-9-23(19)10-8-16/h3-6,11-13,16,19-20,24H,2,7-10H2,1H3