3-[(3R)-3-methoxy-1-azabicyclo[2.2.2]octan-3-yl]-1-phenyl-1-(thian-4-yl)prop-2-yn-1-ol

Systemtic Name: 3-[(3R)-3-methoxy-1-azabicyclo[2.2.2]octan-3-yl]-1-phenyl-1-(thian-4-yl)prop-2-yn-1-ol Openeye Name: 3-[(3R)-3-methoxyquinuclidin-3-yl]-1-phenyl-1-tetrahydrothiopyran-4-yl-prop-2-yn-1-ol CAS Name: 3-[(3R)-3-methoxy-1-azabicyclo[2.2.2]octan-3-yl]-1-phenyl-1-(4-thianyl)-2-propyn-1-ol IUPAC Name: 3-[(3R)-3-methoxy-1-azabicyclo[2.2.2]octan-3-yl]-1-phenyl-1-(thian-4-yl)prop-2-yn-1-ol Traditional Name: 3-[(3R)-3-methoxyquinuclidin-3-yl]-1-phenyl-1-tetrahydrothiopyran-4-yl-prop-2-yn-1-ol Formula: C22H29NO2S MolecularWeight: 371.53616

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Descriptors Computed from Structure

Canonical SMILES:

COC1(CN2CCC1CC2)C#CC(C3CCSCC3)(C4=CC=CC=C4)O

Isomeric SMILES

CO[C@@]1(CN2CCC1CC2)C#CC(C3CCSCC3)(C4=CC=CC=C4)O

InChI

InChI=1S/C22H29NO2S/c1-25-21(17-23-13-7-18(21)8-14-23)11-12-22(24,19-5-3-2-4-6-19)20-9-15-26-16-10-20/h2-6,18,20,24H,7-10,13-17H2,1H3/t21-,22?/m1/s1