diethyl 2-[4-cyano-2,3,5,6-tetrakis(fluoranyl)phenyl]propanedioate

Systemtic Name: diethyl 2-[4-cyano-2,3,5,6-tetrakis(fluoranyl)phenyl]propanedioate Openeye Name: diethyl 2-(4-cyano-2,3,5,6-tetrafluoro-phenyl)propanedioate CAS Name: 2-(4-cyano-2,3,5,6-tetrafluorophenyl)propanedioic acid diethyl ester IUPAC Name: diethyl 2-(4-cyano-2,3,5,6-tetrafluorophenyl)propanedioate Traditional Name: 2-(4-cyano-2,3,5,6-tetrafluoro-phenyl)malonic acid diethyl ester Formula: C14H11F4NO4 MolecularWeight: 333.235053

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C1=C(C(=C(C(=C1F)F)C#N)F)F)C(=O)OCC

Isomeric SMILES

CCOC(=O)C(C1=C(C(=C(C(=C1F)F)C#N)F)F)C(=O)OCC

InChI

InChI=1S/C14H11F4NO4/c1-3-22-13(20)8(14(21)23-4-2)7-11(17)9(15)6(5-19)10(16)12(7)18/h8H,3-4H2,1-2H3