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

Systemtic Name: 1-(1-adamantyl)-3-[(3R)-3-methoxy-1-azabicyclo[2.2.2]octan-3-yl]-1-phenyl-prop-2-yn-1-ol Openeye Name: 1-(1-adamantyl)-3-[(3R)-3-methoxyquinuclidin-3-yl]-1-phenyl-prop-2-yn-1-ol CAS Name: 1-(1-adamantyl)-3-[(3R)-3-methoxy-1-azabicyclo[2.2.2]octan-3-yl]-1-phenyl-2-propyn-1-ol IUPAC Name: 1-(1-adamantyl)-3-[(3R)-3-methoxy-1-azabicyclo[2.2.2]octan-3-yl]-1-phenylprop-2-yn-1-ol Traditional Name: 1-(1-adamantyl)-3-[(3R)-3-methoxyquinuclidin-3-yl]-1-phenyl-prop-2-yn-1-ol Formula: C27H35NO2 MolecularWeight: 405.5723

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Descriptors Computed from Structure

Canonical SMILES:

COC1(CN2CCC1CC2)C#CC(C3=CC=CC=C3)(C45CC6CC(C4)CC(C6)C5)O

Isomeric SMILES

CO[C@@]1(CN2CCC1CC2)C#CC(C3=CC=CC=C3)(C45CC6CC(C4)CC(C6)C5)O

InChI

InChI=1S/C27H35NO2/c1-30-26(19-28-11-7-23(26)8-12-28)9-10-27(29,24-5-3-2-4-6-24)25-16-20-13-21(17-25)15-22(14-20)18-25/h2-6,20-23,29H,7-8,11-19H2,1H3/t20?,21?,22?,25?,26-,27?/m1/s1