3-[(3R)-3-methoxy-1-azabicyclo[2.2.2]octan-3-yl]-1-phenyl-1-(8-thiabicyclo[3.2.1]octan-3-yl)prop-2-yn-1-ol

Systemtic Name: 3-[(3R)-3-methoxy-1-azabicyclo[2.2.2]octan-3-yl]-1-phenyl-1-(8-thiabicyclo[3.2.1]octan-3-yl)prop-2-yn-1-ol Openeye Name: 3-[(3R)-3-methoxyquinuclidin-3-yl]-1-phenyl-1-(8-thiabicyclo[3.2.1]octan-3-yl)prop-2-yn-1-ol CAS Name: 3-[(3R)-3-methoxy-1-azabicyclo[2.2.2]octan-3-yl]-1-phenyl-1-(8-thiabicyclo[3.2.1]octan-3-yl)-2-propyn-1-ol IUPAC Name: 3-[(3R)-3-methoxy-1-azabicyclo[2.2.2]octan-3-yl]-1-phenyl-1-(8-thiabicyclo[3.2.1]octan-3-yl)prop-2-yn-1-ol Traditional Name: 3-[(3R)-3-methoxyquinuclidin-3-yl]-1-phenyl-1-(8-thiabicyclo[3.2.1]octan-3-yl)prop-2-yn-1-ol Formula: C24H31NO2S MolecularWeight: 397.57344

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Descriptors Computed from Structure

Canonical SMILES:

COC1(CN2CCC1CC2)C#CC(C3CC4CCC(C3)S4)(C5=CC=CC=C5)O

Isomeric SMILES

CO[C@@]1(CN2CCC1CC2)C#CC(C3CC4CCC(C3)S4)(C5=CC=CC=C5)O

InChI

InChI=1S/C24H31NO2S/c1-27-23(17-25-13-9-18(23)10-14-25)11-12-24(26,19-5-3-2-4-6-19)20-15-21-7-8-22(16-20)28-21/h2-6,18,20-22,26H,7-10,13-17H2,1H3/t20?,21?,22?,23-,24?/m1/s1