2-[(3R)-1-azabicyclo[2.2.2]octan-3-yl]-5-pyridin-3-yl-3H-isoindol-1-one

Systemtic Name: 2-[(3R)-1-azabicyclo[2.2.2]octan-3-yl]-5-pyridin-3-yl-3H-isoindol-1-one Openeye Name: 5-(3-pyridyl)-2-[(3R)-quinuclidin-3-yl]isoindolin-1-one CAS Name: 2-[(3R)-1-azabicyclo[2.2.2]octan-3-yl]-5-(3-pyridinyl)-3H-isoindol-1-one IUPAC Name: 2-[(3R)-1-azabicyclo[2.2.2]octan-3-yl]-5-pyridin-3-yl-3H-isoindol-1-one Traditional Name: 5-(3-pyridyl)-2-[(3R)-quinuclidin-3-yl]isoindolin-1-one Formula: C20H21N3O MolecularWeight: 319.40024

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN2CCC1C(C2)N3CC4=C(C3=O)C=CC(=C4)C5=CN=CC=C5

Isomeric SMILES

C1CN2CCC1[C@H](C2)N3CC4=C(C3=O)C=CC(=C4)C5=CN=CC=C5

InChI

InChI=1S/C20H21N3O/c24-20-18-4-3-15(16-2-1-7-21-11-16)10-17(18)12-23(20)19-13-22-8-5-14(19)6-9-22/h1-4,7,10-11,14,19H,5-6,8-9,12-13H2/t19-/m0/s1