diethyl 2-ethyl-2-(3-nitropyridin-2-yl)propanedioate

Systemtic Name: diethyl 2-ethyl-2-(3-nitropyridin-2-yl)propanedioate Openeye Name: diethyl 2-ethyl-2-(3-nitro-2-pyridyl)propanedioate CAS Name: 2-ethyl-2-(3-nitro-2-pyridinyl)propanedioic acid diethyl ester IUPAC Name: diethyl 2-ethyl-2-(3-nitropyridin-2-yl)propanedioate Traditional Name: 2-ethyl-2-(3-nitro-2-pyridyl)malonic acid diethyl ester Formula: C14H18N2O6 MolecularWeight: 310.30252

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=C(C=CC=N1)[N+](=O)[O-])(C(=O)OCC)C(=O)OCC

Isomeric SMILES

CCC(C1=C(C=CC=N1)[N+](=O)[O-])(C(=O)OCC)C(=O)OCC

InChI

InChI=1S/C14H18N2O6/c1-4-14(12(17)21-5-2,13(18)22-6-3)11-10(16(19)20)8-7-9-15-11/h7-9H,4-6H2,1-3H3