2-cyanoethyl 4,4,4-tris(fluoranyl)-3-oxidanylidene-butanoate

Systemtic Name: 2-cyanoethyl 4,4,4-tris(fluoranyl)-3-oxidanylidene-butanoate Openeye Name: 2-cyanoethyl 4,4,4-trifluoro-3-oxo-butanoate CAS Name: 4,4,4-trifluoro-3-oxobutanoic acid 2-cyanoethyl ester IUPAC Name: 2-cyanoethyl 4,4,4-trifluoro-3-oxobutanoate Traditional Name: 4,4,4-trifluoro-3-keto-butyric acid 2-cyanoethyl ester Formula: C7H6F3NO3 MolecularWeight: 209.12265

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C7H6F3NO3/c8-7(9,10)5(12)4-6(13)14-3-1-2-11/h1,3-4H2