diethyl 2-(4-chloranyl-5-fluoranyl-2-nitro-phenyl)propanedioate

Systemtic Name: diethyl 2-(4-chloranyl-5-fluoranyl-2-nitro-phenyl)propanedioate Openeye Name: diethyl 2-(4-chloro-5-fluoro-2-nitro-phenyl)propanedioate CAS Name: 2-(4-chloro-5-fluoro-2-nitrophenyl)propanedioic acid diethyl ester IUPAC Name: diethyl 2-(4-chloro-5-fluoro-2-nitrophenyl)propanedioate Traditional Name: 2-(4-chloro-5-fluoro-2-nitro-phenyl)malonic acid diethyl ester Formula: C13H13ClFNO6 MolecularWeight: 333.696823

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H13ClFNO6/c1-3-21-12(17)11(13(18)22-4-2)7-5-9(15)8(14)6-10(7)16(19)20/h5-6,11H,3-4H2,1-2H3