diethyl 2-(5-fluoranyl-2,4-dinitro-phenyl)propanedioate

Systemtic Name: diethyl 2-(5-fluoranyl-2,4-dinitro-phenyl)propanedioate Openeye Name: diethyl 2-(5-fluoro-2,4-dinitro-phenyl)propanedioate CAS Name: 2-(5-fluoro-2,4-dinitrophenyl)propanedioic acid diethyl ester IUPAC Name: diethyl 2-(5-fluoro-2,4-dinitrophenyl)propanedioate Traditional Name: 2-(5-fluoro-2,4-dinitro-phenyl)malonic acid diethyl ester Formula: C13H13FN2O8 MolecularWeight: 344.249323

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C1=CC(=C(C=C1[N+](=O)[O-])[N+](=O)[O-])F)C(=O)OCC

Isomeric SMILES

CCOC(=O)C(C1=CC(=C(C=C1[N+](=O)[O-])[N+](=O)[O-])F)C(=O)OCC

InChI

InChI=1S/C13H13FN2O8/c1-3-23-12(17)11(13(18)24-4-2)7-5-8(14)10(16(21)22)6-9(7)15(19)20/h5-6,11H,3-4H2,1-2H3