diethyl 2-[2,4,5-tris(fluoranyl)-3-methyl-6-nitro-phenyl]carbonylpropanedioate

Systemtic Name: diethyl 2-[2,4,5-tris(fluoranyl)-3-methyl-6-nitro-phenyl]carbonylpropanedioate Openeye Name: diethyl 2-(2,4,5-trifluoro-3-methyl-6-nitro-benzoyl)propanedioate CAS Name: 2-[oxo-(2,4,5-trifluoro-3-methyl-6-nitrophenyl)methyl]propanedioic acid diethyl ester IUPAC Name: diethyl 2-(2,4,5-trifluoro-3-methyl-6-nitrobenzoyl)propanedioate Traditional Name: 2-(2,4,5-trifluoro-3-methyl-6-nitro-benzoyl)malonic acid diethyl ester Formula: C15H14F3NO7 MolecularWeight: 377.26937

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C(=O)C1=C(C(=C(C(=C1F)C)F)F)[N+](=O)[O-])C(=O)OCC

Isomeric SMILES

CCOC(=O)C(C(=O)C1=C(C(=C(C(=C1F)C)F)F)[N+](=O)[O-])C(=O)OCC

InChI

InChI=1S/C15H14F3NO7/c1-4-25-14(21)8(15(22)26-5-2)13(20)7-9(16)6(3)10(17)11(18)12(7)19(23)24/h8H,4-5H2,1-3H3