4-(2-cyano-5-fluoranyl-phenyl)-4-methyl-2-oxidanyl-N-(1-oxidanylidene-2,3-benzoxazin-6-yl)-2-(trifluoromethyl)pentanamide

Systemtic Name: 4-(2-cyano-5-fluoranyl-phenyl)-4-methyl-2-oxidanyl-N-(1-oxidanylidene-2,3-benzoxazin-6-yl)-2-(trifluoromethyl)pentanamide Openeye Name: 4-(2-cyano-5-fluoro-phenyl)-2-hydroxy-4-methyl-N-(1-oxo-2,3-benzoxazin-6-yl)-2-(trifluoromethyl)pentanamide CAS Name: 4-(2-cyano-5-fluorophenyl)-2-hydroxy-4-methyl-N-(1-oxo-2,3-benzoxazin-6-yl)-2-(trifluoromethyl)pentanamide IUPAC Name: 4-(2-cyano-5-fluorophenyl)-2-hydroxy-4-methyl-N-(1-oxo-2,3-benzoxazin-6-yl)-2-(trifluoromethyl)pentanamide Traditional Name: 4-(2-cyano-5-fluoro-phenyl)-2-hydroxy-N-(1-keto-2,3-benzoxazin-6-yl)-4-methyl-2-(trifluoromethyl)valeramide Formula: C22H17F4N3O4 MolecularWeight: 463.381693

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CC(C(=O)NC1=CC2=C(C=C1)C(=O)ON=C2)(C(F)(F)F)O)C3=C(C=CC(=C3)F)C#N

Isomeric SMILES

CC(C)(CC(C(=O)NC1=CC2=C(C=C1)C(=O)ON=C2)(C(F)(F)F)O)C3=C(C=CC(=C3)F)C#N

InChI

InChI=1S/C22H17F4N3O4/c1-20(2,17-8-14(23)4-3-12(17)9-27)11-21(32,22(24,25)26)19(31)29-15-5-6-16-13(7-15)10-28-33-18(16)30/h3-8,10,32H,11H2,1-2H3,(H,29,31)