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

Systemtic Name: 7-methyl-5-pyridin-3-yl-2-[[4-(trifluoromethyloxy)phenyl]amino]-3H-isoindol-1-one Openeye Name: 7-methyl-5-(3-pyridyl)-2-[4-(trifluoromethoxy)anilino]isoindolin-1-one CAS Name: 7-methyl-5-(3-pyridinyl)-2-[4-(trifluoromethoxy)anilino]-3H-isoindol-1-one IUPAC Name: 7-methyl-5-pyridin-3-yl-2-[4-(trifluoromethoxy)anilino]-3H-isoindol-1-one Traditional Name: 7-methyl-5-(3-pyridyl)-2-[4-(trifluoromethoxy)anilino]isoindolin-1-one Formula: C21H16F3N3O2 MolecularWeight: 399.36585

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC2=C1C(=O)N(C2)NC3=CC=C(C=C3)OC(F)(F)F)C4=CN=CC=C4

Isomeric SMILES

CC1=CC(=CC2=C1C(=O)N(C2)NC3=CC=C(C=C3)OC(F)(F)F)C4=CN=CC=C4

InChI

InChI=1S/C21H16F3N3O2/c1-13-9-15(14-3-2-8-25-11-14)10-16-12-27(20(28)19(13)16)26-17-4-6-18(7-5-17)29-21(22,23)24/h2-11,26H,12H2,1H3