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

Systemtic Name: 7-chloranyl-5-pyridin-3-yl-2-[[4-(trifluoromethyloxy)phenyl]methyl]-3H-isoindol-1-one Openeye Name: 7-chloro-5-(3-pyridyl)-2-[[4-(trifluoromethoxy)phenyl]methyl]isoindolin-1-one CAS Name: 7-chloro-5-(3-pyridinyl)-2-[[4-(trifluoromethoxy)phenyl]methyl]-3H-isoindol-1-one IUPAC Name: 7-chloro-5-pyridin-3-yl-2-[[4-(trifluoromethoxy)phenyl]methyl]-3H-isoindol-1-one Traditional Name: 7-chloro-5-(3-pyridyl)-2-[4-(trifluoromethoxy)benzyl]isoindolin-1-one Formula: C21H14ClF3N2O2 MolecularWeight: 418.79627

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Descriptors Computed from Structure

Canonical SMILES:

C1C2=C(C(=CC(=C2)C3=CN=CC=C3)Cl)C(=O)N1CC4=CC=C(C=C4)OC(F)(F)F

Isomeric SMILES

C1C2=C(C(=CC(=C2)C3=CN=CC=C3)Cl)C(=O)N1CC4=CC=C(C=C4)OC(F)(F)F

InChI

InChI=1S/C21H14ClF3N2O2/c22-18-9-15(14-2-1-7-26-10-14)8-16-12-27(20(28)19(16)18)11-13-3-5-17(6-4-13)29-21(23,24)25/h1-10H,11-12H2