1,1,1,3,3,3-hexakis(fluoranyl)propan-2-yl 2-cyanoethanoate

Systemtic Name: 1,1,1,3,3,3-hexakis(fluoranyl)propan-2-yl 2-cyanoethanoate Openeye Name: [2,2,2-trifluoro-1-(trifluoromethyl)ethyl] 2-cyanoacetate CAS Name: 2-cyanoacetic acid 1,1,1,3,3,3-hexafluoropropan-2-yl ester IUPAC Name: 1,1,1,3,3,3-hexafluoropropan-2-yl 2-cyanoacetate Traditional Name: 2-cyanoacetic acid [2,2,2-trifluoro-1-(trifluoromethyl)ethyl] ester Formula: C6H3F6NO2 MolecularWeight: 235.083939

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Descriptors Computed from Structure

Canonical SMILES:

C(C#N)C(=O)OC(C(F)(F)F)C(F)(F)F

Isomeric SMILES

C(C#N)C(=O)OC(C(F)(F)F)C(F)(F)F

InChI

InChI=1S/C6H3F6NO2/c7-5(8,9)4(6(10,11)12)15-3(14)1-2-13/h4H,1H2