ethyl (2S)-2-bromanyl-4,4,4-tris(fluoranyl)-3-oxidanylidene-butanoate

Systemtic Name: ethyl (2S)-2-bromanyl-4,4,4-tris(fluoranyl)-3-oxidanylidene-butanoate Openeye Name: ethyl (2S)-2-bromo-4,4,4-trifluoro-3-oxo-butanoate CAS Name: (2S)-2-bromo-4,4,4-trifluoro-3-oxobutanoic acid ethyl ester IUPAC Name: ethyl (2S)-2-bromo-4,4,4-trifluoro-3-oxobutanoate Traditional Name: (2S)-2-bromo-4,4,4-trifluoro-3-keto-butyric acid ethyl ester Formula: C6H6BrF3O3 MolecularWeight: 263.00925

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C(=O)C(F)(F)F)Br

Isomeric SMILES

CCOC(=O)[C@H](C(=O)C(F)(F)F)Br

InChI

InChI=1S/C6H6BrF3O3/c1-2-13-5(12)3(7)4(11)6(8,9)10/h3H,2H2,1H3/t3-/m0/s1