2-ethynyl-2-(3-methoxy-4-oxidanyl-pyrrolidin-1-yl)-3-pyrimidin-2-yl-1-azabicyclo[2.2.2]octan-3-ol

Systemtic Name: 2-ethynyl-2-(3-methoxy-4-oxidanyl-pyrrolidin-1-yl)-3-pyrimidin-2-yl-1-azabicyclo[2.2.2]octan-3-ol Openeye Name: 2-ethynyl-2-(3-hydroxy-4-methoxy-pyrrolidin-1-yl)-3-pyrimidin-2-yl-quinuclidin-3-ol CAS Name: 2-ethynyl-2-(3-hydroxy-4-methoxy-1-pyrrolidinyl)-3-(2-pyrimidinyl)-1-azabicyclo[2.2.2]octan-3-ol IUPAC Name: 2-ethynyl-2-(3-hydroxy-4-methoxypyrrolidin-1-yl)-3-pyrimidin-2-yl-1-azabicyclo[2.2.2]octan-3-ol Traditional Name: 2-ethynyl-2-(3-hydroxy-4-methoxy-pyrrolidino)-3-(2-pyrimidyl)quinuclidin-3-ol Formula: C18H24N4O3 MolecularWeight: 344.40816

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Descriptors Computed from Structure

Canonical SMILES:

COC1CN(CC1O)C2(C(C3CCN2CC3)(C4=NC=CC=N4)O)C#C

Isomeric SMILES

COC1CN(CC1O)C2(C(C3CCN2CC3)(C4=NC=CC=N4)O)C#C

InChI

InChI=1S/C18H24N4O3/c1-3-17(22-11-14(23)15(12-22)25-2)18(24,16-19-7-4-8-20-16)13-5-9-21(17)10-6-13/h1,4,7-8,13-15,23-24H,5-6,9-12H2,2H3