ethyl (2R)-4-[(2-fluorophenyl)amino]-2-oxidanyl-4-oxidanylidene-2-(trifluoromethyl)butanoate

Systemtic Name: ethyl (2R)-4-[(2-fluorophenyl)amino]-2-oxidanyl-4-oxidanylidene-2-(trifluoromethyl)butanoate Openeye Name: ethyl (2R)-4-(2-fluoroanilino)-2-hydroxy-4-oxo-2-(trifluoromethyl)butanoate CAS Name: (2R)-4-(2-fluoroanilino)-2-hydroxy-4-oxo-2-(trifluoromethyl)butanoic acid ethyl ester IUPAC Name: ethyl (2R)-4-(2-fluoroanilino)-2-hydroxy-4-oxo-2-(trifluoromethyl)butanoate Traditional Name: (2R)-4-(2-fluoroanilino)-2-hydroxy-4-keto-2-(trifluoromethyl)butyric acid ethyl ester Formula: C13H13F4NO4 MolecularWeight: 323.240233

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CC(=O)NC1=CC=CC=C1F)(C(F)(F)F)O

Isomeric SMILES

CCOC(=O)[C@](CC(=O)NC1=CC=CC=C1F)(C(F)(F)F)O

InChI

InChI=1S/C13H13F4NO4/c1-2-22-11(20)12(21,13(15,16)17)7-10(19)18-9-6-4-3-5-8(9)14/h3-6,21H,2,7H2,1H3,(H,18,19)/t12-/m1/s1