diethyl 2-acetamido-2-(5-nitropyridin-2-yl)propanedioate

Systemtic Name: diethyl 2-acetamido-2-(5-nitropyridin-2-yl)propanedioate Openeye Name: diethyl 2-acetamido-2-(5-nitro-2-pyridyl)propanedioate CAS Name: 2-acetamido-2-(5-nitro-2-pyridinyl)propanedioic acid diethyl ester IUPAC Name: diethyl 2-acetamido-2-(5-nitropyridin-2-yl)propanedioate Traditional Name: 2-acetamido-2-(5-nitro-2-pyridyl)malonic acid diethyl ester Formula: C14H17N3O7 MolecularWeight: 339.30068

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H17N3O7/c1-4-23-12(19)14(16-9(3)18,13(20)24-5-2)11-7-6-10(8-15-11)17(21)22/h6-8H,4-5H2,1-3H3,(H,16,18)