7-[(2-methoxypyridin-4-yl)methylamino]-2-[4-(trifluoromethyloxy)phenyl]-3H-isoindol-1-one

Systemtic Name: 7-[(2-methoxypyridin-4-yl)methylamino]-2-[4-(trifluoromethyloxy)phenyl]-3H-isoindol-1-one Openeye Name: 7-[(2-methoxy-4-pyridyl)methylamino]-2-[4-(trifluoromethoxy)phenyl]isoindolin-1-one CAS Name: 7-[(2-methoxy-4-pyridinyl)methylamino]-2-[4-(trifluoromethoxy)phenyl]-3H-isoindol-1-one IUPAC Name: 7-[(2-methoxypyridin-4-yl)methylamino]-2-[4-(trifluoromethoxy)phenyl]-3H-isoindol-1-one Traditional Name: 7-[(2-methoxy-4-pyridyl)methylamino]-2-[4-(trifluoromethoxy)phenyl]isoindolin-1-one Formula: C22H18F3N3O3 MolecularWeight: 429.39183

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=NC=CC(=C1)CNC2=CC=CC3=C2C(=O)N(C3)C4=CC=C(C=C4)OC(F)(F)F

Isomeric SMILES

COC1=NC=CC(=C1)CNC2=CC=CC3=C2C(=O)N(C3)C4=CC=C(C=C4)OC(F)(F)F

InChI

InChI=1S/C22H18F3N3O3/c1-30-19-11-14(9-10-26-19)12-27-18-4-2-3-15-13-28(21(29)20(15)18)16-5-7-17(8-6-16)31-22(23,24)25/h2-11,27H,12-13H2,1H3