diethyl 2-[5-fluoranyl-2-(trifluoromethyl)phenyl]propanedioate

Systemtic Name: diethyl 2-[5-fluoranyl-2-(trifluoromethyl)phenyl]propanedioate Openeye Name: diethyl 2-[5-fluoro-2-(trifluoromethyl)phenyl]propanedioate CAS Name: 2-[5-fluoro-2-(trifluoromethyl)phenyl]propanedioic acid diethyl ester IUPAC Name: diethyl 2-[5-fluoro-2-(trifluoromethyl)phenyl]propanedioate Traditional Name: 2-[5-fluoro-2-(trifluoromethyl)phenyl]malonic acid diethyl ester Formula: C14H14F4O4 MolecularWeight: 322.252173

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C1=C(C=CC(=C1)F)C(F)(F)F)C(=O)OCC

Isomeric SMILES

CCOC(=O)C(C1=C(C=CC(=C1)F)C(F)(F)F)C(=O)OCC

InChI

InChI=1S/C14H14F4O4/c1-3-21-12(19)11(13(20)22-4-2)9-7-8(15)5-6-10(9)14(16,17)18/h5-7,11H,3-4H2,1-2H3