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

Systemtic Name: 7-(oxan-4-ylamino)-2-[3-(oxolan-2-ylmethoxy)-5-(trifluoromethyl)phenyl]-3H-isoindol-1-one Openeye Name: 2-[3-(tetrahydrofuran-2-ylmethoxy)-5-(trifluoromethyl)phenyl]-7-(tetrahydropyran-4-ylamino)isoindolin-1-one CAS Name: 7-(4-oxanylamino)-2-[3-(2-oxolanylmethoxy)-5-(trifluoromethyl)phenyl]-3H-isoindol-1-one IUPAC Name: 7-(oxan-4-ylamino)-2-[3-(oxolan-2-ylmethoxy)-5-(trifluoromethyl)phenyl]-3H-isoindol-1-one Traditional Name: 2-[3-(tetrahydrofurfuryloxy)-5-(trifluoromethyl)phenyl]-7-(tetrahydropyran-4-ylamino)isoindolin-1-one Formula: C25H27F3N2O4 MolecularWeight: 476.48809

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(OC1)COC2=CC(=CC(=C2)N3CC4=C(C3=O)C(=CC=C4)NC5CCOCC5)C(F)(F)F

Isomeric SMILES

C1CC(OC1)COC2=CC(=CC(=C2)N3CC4=C(C3=O)C(=CC=C4)NC5CCOCC5)C(F)(F)F

InChI

InChI=1S/C25H27F3N2O4/c26-25(27,28)17-11-19(13-21(12-17)34-15-20-4-2-8-33-20)30-14-16-3-1-5-22(23(16)24(30)31)29-18-6-9-32-10-7-18/h1,3,5,11-13,18,20,29H,2,4,6-10,14-15H2