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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CN=CC(=C1)C2=CC=C(C=C2)C3(CN4CCC3CC4)O

Isomeric SMILES

CCOC(=O)C1=CN=CC(=C1)C2=CC=C(C=C2)C3(CN4CCC3CC4)O

InChI

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