ethyl 3-[2-(3-oxidanyl-1-azabicyclo[2.2.2]octan-3-yl)ethynyl]benzoate

Systemtic Name: ethyl 3-[2-(3-oxidanyl-1-azabicyclo[2.2.2]octan-3-yl)ethynyl]benzoate Openeye Name: ethyl 3-[2-(3-hydroxyquinuclidin-3-yl)ethynyl]benzoate CAS Name: 3-[2-(3-hydroxy-1-azabicyclo[2.2.2]octan-3-yl)ethynyl]benzoic acid ethyl ester IUPAC Name: ethyl 3-[2-(3-hydroxy-1-azabicyclo[2.2.2]octan-3-yl)ethynyl]benzoate Traditional Name: 3-[2-(3-hydroxyquinuclidin-3-yl)ethynyl]benzoic acid ethyl ester Formula: C18H21NO3 MolecularWeight: 299.36424

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=CC(=C1)C#CC2(CN3CCC2CC3)O

Isomeric SMILES

CCOC(=O)C1=CC=CC(=C1)C#CC2(CN3CCC2CC3)O

InChI

InChI=1S/C18H21NO3/c1-2-22-17(20)15-5-3-4-14(12-15)6-9-18(21)13-19-10-7-16(18)8-11-19/h3-5,12,16,21H,2,7-8,10-11,13H2,1H3