2-[3-(oxolan-2-ylmethoxy)-5-(trifluoromethyl)phenyl]-7-(pyridin-4-ylmethylamino)-3H-isoindol-1-one

Systemtic Name: 2-[3-(oxolan-2-ylmethoxy)-5-(trifluoromethyl)phenyl]-7-(pyridin-4-ylmethylamino)-3H-isoindol-1-one Openeye Name: 7-(4-pyridylmethylamino)-2-[3-(tetrahydrofuran-2-ylmethoxy)-5-(trifluoromethyl)phenyl]isoindolin-1-one CAS Name: 2-[3-(2-oxolanylmethoxy)-5-(trifluoromethyl)phenyl]-7-(pyridin-4-ylmethylamino)-3H-isoindol-1-one IUPAC Name: 2-[3-(oxolan-2-ylmethoxy)-5-(trifluoromethyl)phenyl]-7-(pyridin-4-ylmethylamino)-3H-isoindol-1-one Traditional Name: 7-(4-pyridylmethylamino)-2-[3-(tetrahydrofurfuryloxy)-5-(trifluoromethyl)phenyl]isoindolin-1-one Formula: C26H24F3N3O3 MolecularWeight: 483.48227

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(OC1)COC2=CC(=CC(=C2)N3CC4=C(C3=O)C(=CC=C4)NCC5=CC=NC=C5)C(F)(F)F

Isomeric SMILES

C1CC(OC1)COC2=CC(=CC(=C2)N3CC4=C(C3=O)C(=CC=C4)NCC5=CC=NC=C5)C(F)(F)F

InChI

InChI=1S/C26H24F3N3O3/c27-26(28,29)19-11-20(13-22(12-19)35-16-21-4-2-10-34-21)32-15-18-3-1-5-23(24(18)25(32)33)31-14-17-6-8-30-9-7-17/h1,3,5-9,11-13,21,31H,2,4,10,14-16H2