2-ethynyl-3-(oxan-2-ylmethoxy)-2-pyridin-3-yl-1-azabicyclo[2.2.2]octan-3-ol

Systemtic Name: 2-ethynyl-3-(oxan-2-ylmethoxy)-2-pyridin-3-yl-1-azabicyclo[2.2.2]octan-3-ol Openeye Name: 2-ethynyl-2-(3-pyridyl)-3-(tetrahydropyran-2-ylmethoxy)quinuclidin-3-ol CAS Name: 2-ethynyl-3-(2-oxanylmethoxy)-2-(3-pyridinyl)-1-azabicyclo[2.2.2]octan-3-ol IUPAC Name: 2-ethynyl-3-(oxan-2-ylmethoxy)-2-pyridin-3-yl-1-azabicyclo[2.2.2]octan-3-ol Traditional Name: 2-ethynyl-2-(3-pyridyl)-3-(tetrahydropyran-2-ylmethoxy)quinuclidin-3-ol Formula: C20H26N2O3 MolecularWeight: 342.43204

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Descriptors Computed from Structure

Canonical SMILES:

C#CC1(C(C2CCN1CC2)(O)OCC3CCCCO3)C4=CN=CC=C4

Isomeric SMILES

C#CC1(C(C2CCN1CC2)(O)OCC3CCCCO3)C4=CN=CC=C4

InChI

InChI=1S/C20H26N2O3/c1-2-19(17-6-5-10-21-14-17)20(23,16-8-11-22(19)12-9-16)25-15-18-7-3-4-13-24-18/h1,5-6,10,14,16,18,23H,3-4,7-9,11-13,15H2