3-[[4-(2-phenylethynyl)phenyl]methoxy]-1-azabicyclo[2.2.2]octane

Systemtic Name: 3-[[4-(2-phenylethynyl)phenyl]methoxy]-1-azabicyclo[2.2.2]octane Openeye Name: 3-[[4-(2-phenylethynyl)phenyl]methoxy]quinuclidine CAS Name: 3-[[4-(2-phenylethynyl)phenyl]methoxy]-1-azabicyclo[2.2.2]octane IUPAC Name: 3-[[4-(2-phenylethynyl)phenyl]methoxy]-1-azabicyclo[2.2.2]octane Traditional Name: 3-[4-(2-phenylethynyl)benzyl]oxyquinuclidine Formula: C22H23NO MolecularWeight: 317.42412

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Descriptors Computed from Structure

Canonical SMILES:

C1CN2CCC1C(C2)OCC3=CC=C(C=C3)C#CC4=CC=CC=C4

Isomeric SMILES

C1CN2CCC1C(C2)OCC3=CC=C(C=C3)C#CC4=CC=CC=C4

InChI

InChI=1S/C22H23NO/c1-2-4-18(5-3-1)6-7-19-8-10-20(11-9-19)17-24-22-16-23-14-12-21(22)13-15-23/h1-5,8-11,21-22H,12-17H2