diethyl 2-(2,4-dinitrophenyl)propanedioate

Systemtic Name: diethyl 2-(2,4-dinitrophenyl)propanedioate Openeye Name: diethyl 2-(2,4-dinitrophenyl)propanedioate CAS Name: 2-(2,4-dinitrophenyl)propanedioic acid diethyl ester IUPAC Name: diethyl 2-(2,4-dinitrophenyl)propanedioate Traditional Name: 2-(2,4-dinitrophenyl)malonic acid diethyl ester Formula: C13H14N2O8 MolecularWeight: 326.25886

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H14N2O8/c1-3-22-12(16)11(13(17)23-4-2)9-6-5-8(14(18)19)7-10(9)15(20)21/h5-7,11H,3-4H2,1-2H3