ethyl 2-[2-bromanyl-4,5-bis(fluoranyl)phenyl]carbonyl-3-oxidanylidene-butanoate

Systemtic Name: ethyl 2-[2-bromanyl-4,5-bis(fluoranyl)phenyl]carbonyl-3-oxidanylidene-butanoate Openeye Name: ethyl 2-(2-bromo-4,5-difluoro-benzoyl)-3-oxo-butanoate CAS Name: 2-[(2-bromo-4,5-difluorophenyl)-oxomethyl]-3-oxobutanoic acid ethyl ester IUPAC Name: ethyl 2-(2-bromo-4,5-difluorobenzoyl)-3-oxobutanoate Traditional Name: 2-(2-bromo-4,5-difluoro-benzoyl)-3-keto-butyric acid ethyl ester Formula: C13H11BrF2O4 MolecularWeight: 349.124846

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C(=O)C)C(=O)C1=CC(=C(C=C1Br)F)F

Isomeric SMILES

CCOC(=O)C(C(=O)C)C(=O)C1=CC(=C(C=C1Br)F)F

InChI

InChI=1S/C13H11BrF2O4/c1-3-20-13(19)11(6(2)17)12(18)7-4-9(15)10(16)5-8(7)14/h4-5,11H,3H2,1-2H3