ethyl 6-[4-chloranyl-3-(trifluoromethyl)phenyl]-2-oxidanyl-4-oxidanylidene-cyclohex-2-ene-1-carboxylate

Systemtic Name: ethyl 6-[4-chloranyl-3-(trifluoromethyl)phenyl]-2-oxidanyl-4-oxidanylidene-cyclohex-2-ene-1-carboxylate Openeye Name: ethyl 6-[4-chloro-3-(trifluoromethyl)phenyl]-2-hydroxy-4-oxo-cyclohex-2-ene-1-carboxylate CAS Name: 6-[4-chloro-3-(trifluoromethyl)phenyl]-2-hydroxy-4-oxo-1-cyclohex-2-enecarboxylic acid ethyl ester IUPAC Name: ethyl 6-[4-chloro-3-(trifluoromethyl)phenyl]-2-hydroxy-4-oxocyclohex-2-ene-1-carboxylate Traditional Name: 6-[4-chloro-3-(trifluoromethyl)phenyl]-2-hydroxy-4-keto-cyclohex-2-ene-1-carboxylic acid ethyl ester Formula: C16H14ClF3O4 MolecularWeight: 362.72817

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1C(CC(=O)C=C1O)C2=CC(=C(C=C2)Cl)C(F)(F)F

Isomeric SMILES

CCOC(=O)C1C(CC(=O)C=C1O)C2=CC(=C(C=C2)Cl)C(F)(F)F

InChI

InChI=1S/C16H14ClF3O4/c1-2-24-15(23)14-10(6-9(21)7-13(14)22)8-3-4-12(17)11(5-8)16(18,19)20/h3-5,7,10,14,22H,2,6H2,1H3