methyl (E)-2-cyano-6,6,6-tris(fluoranyl)-5-oxidanylidene-hex-2-enoate

Systemtic Name: methyl (E)-2-cyano-6,6,6-tris(fluoranyl)-5-oxidanylidene-hex-2-enoate Openeye Name: methyl (E)-2-cyano-6,6,6-trifluoro-5-oxo-hex-2-enoate CAS Name: (E)-2-cyano-6,6,6-trifluoro-5-oxo-2-hexenoic acid methyl ester IUPAC Name: methyl (E)-2-cyano-6,6,6-trifluoro-5-oxohex-2-enoate Traditional Name: (E)-2-cyano-6,6,6-trifluoro-5-keto-hex-2-enoic acid methyl ester Formula: C8H6F3NO3 MolecularWeight: 221.13335

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(=CCC(=O)C(F)(F)F)C#N

Isomeric SMILES

COC(=O)/C(=C/CC(=O)C(F)(F)F)/C#N

InChI

InChI=1S/C8H6F3NO3/c1-15-7(14)5(4-12)2-3-6(13)8(9,10)11/h2H,3H2,1H3/b5-2+