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

Systemtic Name: 2-[(3R)-1-azabicyclo[2.2.2]octan-3-yl]-5-phenyl-3H-isoindol-1-one Openeye Name: 5-phenyl-2-[(3R)-quinuclidin-3-yl]isoindolin-1-one CAS Name: 2-[(3R)-1-azabicyclo[2.2.2]octan-3-yl]-5-phenyl-3H-isoindol-1-one IUPAC Name: 2-[(3R)-1-azabicyclo[2.2.2]octan-3-yl]-5-phenyl-3H-isoindol-1-one Traditional Name: 5-phenyl-2-[(3R)-quinuclidin-3-yl]isoindolin-1-one Formula: C21H22N2O MolecularWeight: 318.41218

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H22N2O/c24-21-19-7-6-17(15-4-2-1-3-5-15)12-18(19)13-23(21)20-14-22-10-8-16(20)9-11-22/h1-7,12,16,20H,8-11,13-14H2/t20-/m0/s1