3-(3,4-diethoxypyrrolidin-1-yl)-2-ethynyl-2-pyridin-3-yl-1-azabicyclo[2.2.2]octan-3-ol

Systemtic Name: 3-(3,4-diethoxypyrrolidin-1-yl)-2-ethynyl-2-pyridin-3-yl-1-azabicyclo[2.2.2]octan-3-ol Openeye Name: 3-(3,4-diethoxypyrrolidin-1-yl)-2-ethynyl-2-(3-pyridyl)quinuclidin-3-ol CAS Name: 3-(3,4-diethoxy-1-pyrrolidinyl)-2-ethynyl-2-(3-pyridinyl)-1-azabicyclo[2.2.2]octan-3-ol IUPAC Name: 3-(3,4-diethoxypyrrolidin-1-yl)-2-ethynyl-2-pyridin-3-yl-1-azabicyclo[2.2.2]octan-3-ol Traditional Name: 3-(3,4-diethoxypyrrolidino)-2-ethynyl-2-(3-pyridyl)quinuclidin-3-ol Formula: C22H31N3O3 MolecularWeight: 385.49984

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1CN(CC1OCC)C2(C3CCN(C2(C#C)C4=CN=CC=C4)CC3)O

Isomeric SMILES

CCOC1CN(CC1OCC)C2(C3CCN(C2(C#C)C4=CN=CC=C4)CC3)O

InChI

InChI=1S/C22H31N3O3/c1-4-21(18-8-7-11-23-14-18)22(26,17-9-12-24(21)13-10-17)25-15-19(27-5-2)20(16-25)28-6-3/h1,7-8,11,14,17,19-20,26H,5-6,9-10,12-13,15-16H2,2-3H3