methyl 4-[(4-chloranyl-2-fluoranyl-phenyl)amino]-2-oxidanyl-4-oxidanylidene-2-(trifluoromethyl)butanoate

Systemtic Name: methyl 4-[(4-chloranyl-2-fluoranyl-phenyl)amino]-2-oxidanyl-4-oxidanylidene-2-(trifluoromethyl)butanoate Openeye Name: methyl 4-(4-chloro-2-fluoro-anilino)-2-hydroxy-4-oxo-2-(trifluoromethyl)butanoate CAS Name: 4-(4-chloro-2-fluoroanilino)-2-hydroxy-4-oxo-2-(trifluoromethyl)butanoic acid methyl ester IUPAC Name: methyl 4-(4-chloro-2-fluoroanilino)-2-hydroxy-4-oxo-2-(trifluoromethyl)butanoate Traditional Name: 4-(4-chloro-2-fluoro-anilino)-2-hydroxy-4-keto-2-(trifluoromethyl)butyric acid methyl ester Formula: C12H10ClF4NO4 MolecularWeight: 343.658713

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(CC(=O)NC1=C(C=C(C=C1)Cl)F)(C(F)(F)F)O

Isomeric SMILES

COC(=O)C(CC(=O)NC1=C(C=C(C=C1)Cl)F)(C(F)(F)F)O

InChI

InChI=1S/C12H10ClF4NO4/c1-22-10(20)11(21,12(15,16)17)5-9(19)18-8-3-2-6(13)4-7(8)14/h2-4,21H,5H2,1H3,(H,18,19)