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

Systemtic Name: 2-ethynyl-2-morpholin-4-yl-4-(phenylmethyl)-3-pyridin-3-yl-1-azabicyclo[2.2.2]octan-3-ol Openeye Name: 4-benzyl-2-ethynyl-2-morpholino-3-(3-pyridyl)quinuclidin-3-ol CAS Name: 2-ethynyl-2-(4-morpholinyl)-4-(phenylmethyl)-3-(3-pyridinyl)-1-azabicyclo[2.2.2]octan-3-ol IUPAC Name: 4-benzyl-2-ethynyl-2-morpholin-4-yl-3-pyridin-3-yl-1-azabicyclo[2.2.2]octan-3-ol Traditional Name: 4-benzyl-2-ethynyl-2-morpholino-3-(3-pyridyl)quinuclidin-3-ol Formula: C25H29N3O2 MolecularWeight: 403.51666

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Descriptors Computed from Structure

Canonical SMILES:

C#CC1(C(C2(CCN1CC2)CC3=CC=CC=C3)(C4=CN=CC=C4)O)N5CCOCC5

Isomeric SMILES

C#CC1(C(C2(CCN1CC2)CC3=CC=CC=C3)(C4=CN=CC=C4)O)N5CCOCC5

InChI

InChI=1S/C25H29N3O2/c1-2-24(28-15-17-30-18-16-28)25(29,22-9-6-12-26-20-22)23(10-13-27(24)14-11-23)19-21-7-4-3-5-8-21/h1,3-9,12,20,29H,10-11,13-19H2