2-[[4-(2-fluoranylphenoxy)phenyl]methyl]-7-methyl-5-pyridin-3-yl-3H-isoindol-1-one

Systemtic Name: 2-[[4-(2-fluoranylphenoxy)phenyl]methyl]-7-methyl-5-pyridin-3-yl-3H-isoindol-1-one Openeye Name: 2-[[4-(2-fluorophenoxy)phenyl]methyl]-7-methyl-5-(3-pyridyl)isoindolin-1-one CAS Name: 2-[[4-(2-fluorophenoxy)phenyl]methyl]-7-methyl-5-(3-pyridinyl)-3H-isoindol-1-one IUPAC Name: 2-[[4-(2-fluorophenoxy)phenyl]methyl]-7-methyl-5-pyridin-3-yl-3H-isoindol-1-one Traditional Name: 2-[4-(2-fluorophenoxy)benzyl]-7-methyl-5-(3-pyridyl)isoindolin-1-one Formula: C27H21FN2O2 MolecularWeight: 424.466243

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC2=C1C(=O)N(C2)CC3=CC=C(C=C3)OC4=CC=CC=C4F)C5=CN=CC=C5

Isomeric SMILES

CC1=CC(=CC2=C1C(=O)N(C2)CC3=CC=C(C=C3)OC4=CC=CC=C4F)C5=CN=CC=C5

InChI

InChI=1S/C27H21FN2O2/c1-18-13-21(20-5-4-12-29-15-20)14-22-17-30(27(31)26(18)22)16-19-8-10-23(11-9-19)32-25-7-3-2-6-24(25)28/h2-15H,16-17H2,1H3