3-[3-(4-fluorophenyl)-2-pyridin-4-yl-pyrrol-1-yl]-1-azabicyclo[2.2.2]octane

Systemtic Name: 3-[3-(4-fluorophenyl)-2-pyridin-4-yl-pyrrol-1-yl]-1-azabicyclo[2.2.2]octane Openeye Name: 3-[3-(4-fluorophenyl)-2-(4-pyridyl)pyrrol-1-yl]quinuclidine CAS Name: 3-[3-(4-fluorophenyl)-2-pyridin-4-yl-1-pyrrolyl]-1-azabicyclo[2.2.2]octane IUPAC Name: 3-[3-(4-fluorophenyl)-2-pyridin-4-ylpyrrol-1-yl]-1-azabicyclo[2.2.2]octane Traditional Name: 3-[3-(4-fluorophenyl)-2-(4-pyridyl)pyrrol-1-yl]quinuclidine Formula: C22H22FN3 MolecularWeight: 347.428583

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN2CCC1C(C2)N3C=CC(=C3C4=CC=NC=C4)C5=CC=C(C=C5)F

Isomeric SMILES

C1CN2CCC1C(C2)N3C=CC(=C3C4=CC=NC=C4)C5=CC=C(C=C5)F

InChI

InChI=1S/C22H22FN3/c23-19-3-1-16(2-4-19)20-9-14-26(22(20)18-5-10-24-11-6-18)21-15-25-12-7-17(21)8-13-25/h1-6,9-11,14,17,21H,7-8,12-13,15H2