2-[(3R)-1-azabicyclo[2.2.2]octan-3-yl]-5-pyridin-4-yl-3H-isoindol-1-one

Systemtic Name: 2-[(3R)-1-azabicyclo[2.2.2]octan-3-yl]-5-pyridin-4-yl-3H-isoindol-1-one Openeye Name: 5-(4-pyridyl)-2-[(3R)-quinuclidin-3-yl]isoindolin-1-one CAS Name: 2-[(3R)-1-azabicyclo[2.2.2]octan-3-yl]-5-pyridin-4-yl-3H-isoindol-1-one IUPAC Name: 2-[(3R)-1-azabicyclo[2.2.2]octan-3-yl]-5-pyridin-4-yl-3H-isoindol-1-one Traditional Name: 5-(4-pyridyl)-2-[(3R)-quinuclidin-3-yl]isoindolin-1-one Formula: C20H21N3O MolecularWeight: 319.40024

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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