dimethyl 2-[(Z)-5-oxidanyl-3-oxidanylidene-5-[4-(trifluoromethyl)phenyl]pent-4-enyl]propanedioate

Systemtic Name: dimethyl 2-[(Z)-5-oxidanyl-3-oxidanylidene-5-[4-(trifluoromethyl)phenyl]pent-4-enyl]propanedioate Openeye Name: dimethyl 2-[(Z)-5-hydroxy-3-oxo-5-[4-(trifluoromethyl)phenyl]pent-4-enyl]propanedioate CAS Name: 2-[(Z)-5-hydroxy-3-oxo-5-[4-(trifluoromethyl)phenyl]pent-4-enyl]propanedioic acid dimethyl ester IUPAC Name: dimethyl 2-[(Z)-5-hydroxy-3-oxo-5-[4-(trifluoromethyl)phenyl]pent-4-enyl]propanedioate Traditional Name: 2-[(Z)-5-hydroxy-3-keto-5-[4-(trifluoromethyl)phenyl]pent-4-enyl]malonic acid dimethyl ester Formula: C17H17F3O6 MolecularWeight: 374.30849

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(CCC(=O)C=C(C1=CC=C(C=C1)C(F)(F)F)O)C(=O)OC

Isomeric SMILES

COC(=O)C(CCC(=O)/C=C(/C1=CC=C(C=C1)C(F)(F)F)\O)C(=O)OC

InChI

InChI=1S/C17H17F3O6/c1-25-15(23)13(16(24)26-2)8-7-12(21)9-14(22)10-3-5-11(6-4-10)17(18,19)20/h3-6,9,13,22H,7-8H2,1-2H3/b14-9-