methyl 6-[2-(3-oxidanyl-1-azabicyclo[2.2.2]octan-3-yl)ethynyl]pyridine-3-carboxylate

Systemtic Name: methyl 6-[2-(3-oxidanyl-1-azabicyclo[2.2.2]octan-3-yl)ethynyl]pyridine-3-carboxylate Openeye Name: methyl 6-[2-(3-hydroxyquinuclidin-3-yl)ethynyl]pyridine-3-carboxylate CAS Name: 6-[2-(3-hydroxy-1-azabicyclo[2.2.2]octan-3-yl)ethynyl]-3-pyridinecarboxylic acid methyl ester IUPAC Name: methyl 6-[2-(3-hydroxy-1-azabicyclo[2.2.2]octan-3-yl)ethynyl]pyridine-3-carboxylate Traditional Name: 6-[2-(3-hydroxyquinuclidin-3-yl)ethynyl]nicotinic acid methyl ester Formula: C16H18N2O3 MolecularWeight: 286.32572

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CN=C(C=C1)C#CC2(CN3CCC2CC3)O

Isomeric SMILES

COC(=O)C1=CN=C(C=C1)C#CC2(CN3CCC2CC3)O

InChI

InChI=1S/C16H18N2O3/c1-21-15(19)12-2-3-14(17-10-12)4-7-16(20)11-18-8-5-13(16)6-9-18/h2-3,10,13,20H,5-6,8-9,11H2,1H3