4-(4-bromanyl-2-chloranyl-phenyl)-4-methyl-2-oxidanyl-N-(1-oxidanylidene-2,3-benzoxazin-6-yl)-2-(trifluoromethyl)pentanamide

Systemtic Name: 4-(4-bromanyl-2-chloranyl-phenyl)-4-methyl-2-oxidanyl-N-(1-oxidanylidene-2,3-benzoxazin-6-yl)-2-(trifluoromethyl)pentanamide Openeye Name: 4-(4-bromo-2-chloro-phenyl)-2-hydroxy-4-methyl-N-(1-oxo-2,3-benzoxazin-6-yl)-2-(trifluoromethyl)pentanamide CAS Name: 4-(4-bromo-2-chlorophenyl)-2-hydroxy-4-methyl-N-(1-oxo-2,3-benzoxazin-6-yl)-2-(trifluoromethyl)pentanamide IUPAC Name: 4-(4-bromo-2-chlorophenyl)-2-hydroxy-4-methyl-N-(1-oxo-2,3-benzoxazin-6-yl)-2-(trifluoromethyl)pentanamide Traditional Name: 4-(4-bromo-2-chloro-phenyl)-2-hydroxy-N-(1-keto-2,3-benzoxazin-6-yl)-4-methyl-2-(trifluoromethyl)valeramide Formula: C21H17BrClF3N2O4 MolecularWeight: 533.72289

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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=C(C=C3)Br)Cl

Isomeric SMILES

CC(C)(CC(C(=O)NC1=CC2=C(C=C1)C(=O)ON=C2)(C(F)(F)F)O)C3=C(C=C(C=C3)Br)Cl

InChI

InChI=1S/C21H17BrClF3N2O4/c1-19(2,15-6-3-12(22)8-16(15)23)10-20(31,21(24,25)26)18(30)28-13-4-5-14-11(7-13)9-27-32-17(14)29/h3-9,31H,10H2,1-2H3,(H,28,30)