diethyl 2-[5,6-bis(chloranyl)-3-nitro-pyridin-2-yl]propanedioate

Systemtic Name: diethyl 2-[5,6-bis(chloranyl)-3-nitro-pyridin-2-yl]propanedioate Openeye Name: diethyl 2-(5,6-dichloro-3-nitro-2-pyridyl)propanedioate CAS Name: 2-(5,6-dichloro-3-nitro-2-pyridinyl)propanedioic acid diethyl ester IUPAC Name: diethyl 2-(5,6-dichloro-3-nitropyridin-2-yl)propanedioate Traditional Name: 2-(5,6-dichloro-3-nitro-2-pyridyl)malonic acid diethyl ester Formula: C12H12Cl2N2O6 MolecularWeight: 351.13948

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H12Cl2N2O6/c1-3-21-11(17)8(12(18)22-4-2)9-7(16(19)20)5-6(13)10(14)15-9/h5,8H,3-4H2,1-2H3