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

Systemtic Name: 2-ethynyl-2-(2-methoxyethoxy)-4-(phenylmethyl)-3-pyridin-3-yl-1-azabicyclo[2.2.2]octan-3-ol Openeye Name: 4-benzyl-2-ethynyl-2-(2-methoxyethoxy)-3-(3-pyridyl)quinuclidin-3-ol CAS Name: 2-ethynyl-2-(2-methoxyethoxy)-4-(phenylmethyl)-3-(3-pyridinyl)-1-azabicyclo[2.2.2]octan-3-ol IUPAC Name: 4-benzyl-2-ethynyl-2-(2-methoxyethoxy)-3-pyridin-3-yl-1-azabicyclo[2.2.2]octan-3-ol Traditional Name: 4-benzyl-2-ethynyl-2-(2-methoxyethoxy)-3-(3-pyridyl)quinuclidin-3-ol Formula: C24H28N2O3 MolecularWeight: 392.49072

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Descriptors Computed from Structure

Canonical SMILES:

COCCOC1(C(C2(CCN1CC2)CC3=CC=CC=C3)(C4=CN=CC=C4)O)C#C

Isomeric SMILES

COCCOC1(C(C2(CCN1CC2)CC3=CC=CC=C3)(C4=CN=CC=C4)O)C#C

InChI

InChI=1S/C24H28N2O3/c1-3-23(29-17-16-28-2)24(27,21-10-7-13-25-19-21)22(11-14-26(23)15-12-22)18-20-8-5-4-6-9-20/h1,4-10,13,19,27H,11-12,14-18H2,2H3