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

Systemtic Name: 4-(2-cyano-5-fluoranyl-phenyl)-4-methyl-N-(4-methyl-1-oxidanylidene-2,3-benzoxazin-6-yl)-2-oxidanyl-2-(trifluoromethyl)pentanamide Openeye Name: 4-(2-cyano-5-fluoro-phenyl)-2-hydroxy-4-methyl-N-(4-methyl-1-oxo-2,3-benzoxazin-6-yl)-2-(trifluoromethyl)pentanamide CAS Name: 4-(2-cyano-5-fluorophenyl)-2-hydroxy-4-methyl-N-(4-methyl-1-oxo-2,3-benzoxazin-6-yl)-2-(trifluoromethyl)pentanamide IUPAC Name: 4-(2-cyano-5-fluorophenyl)-2-hydroxy-4-methyl-N-(4-methyl-1-oxo-2,3-benzoxazin-6-yl)-2-(trifluoromethyl)pentanamide Traditional Name: 4-(2-cyano-5-fluoro-phenyl)-2-hydroxy-N-(1-keto-4-methyl-2,3-benzoxazin-6-yl)-4-methyl-2-(trifluoromethyl)valeramide Formula: C23H19F4N3O4 MolecularWeight: 477.408273

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NOC(=O)C2=C1C=C(C=C2)NC(=O)C(CC(C)(C)C3=C(C=CC(=C3)F)C#N)(C(F)(F)F)O

Isomeric SMILES

CC1=NOC(=O)C2=C1C=C(C=C2)NC(=O)C(CC(C)(C)C3=C(C=CC(=C3)F)C#N)(C(F)(F)F)O

InChI

InChI=1S/C23H19F4N3O4/c1-12-17-9-15(6-7-16(17)19(31)34-30-12)29-20(32)22(33,23(25,26)27)11-21(2,3)18-8-14(24)5-4-13(18)10-28/h4-9,33H,11H2,1-3H3,(H,29,32)