methyl 3-chloranyl-4-[(3-chlorophenyl)amino]-2-oxidanyl-4-oxidanylidene-2-(trifluoromethyl)butanoate

Systemtic Name: methyl 3-chloranyl-4-[(3-chlorophenyl)amino]-2-oxidanyl-4-oxidanylidene-2-(trifluoromethyl)butanoate Openeye Name: methyl 3-chloro-4-(3-chloroanilino)-2-hydroxy-4-oxo-2-(trifluoromethyl)butanoate CAS Name: 3-chloro-4-(3-chloroanilino)-2-hydroxy-4-oxo-2-(trifluoromethyl)butanoic acid methyl ester IUPAC Name: methyl 3-chloro-4-(3-chloroanilino)-2-hydroxy-4-oxo-2-(trifluoromethyl)butanoate Traditional Name: 3-chloro-4-(3-chloroanilino)-2-hydroxy-4-keto-2-(trifluoromethyl)butyric acid methyl ester Formula: C12H10Cl2F3NO4 MolecularWeight: 360.11331

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H10Cl2F3NO4/c1-22-10(20)11(21,12(15,16)17)8(14)9(19)18-7-4-2-3-6(13)5-7/h2-5,8,21H,1H3,(H,18,19)