diethyl 2-(4-nitro-1H-imidazol-5-yl)propanedioate

Systemtic Name: diethyl 2-(4-nitro-1H-imidazol-5-yl)propanedioate Openeye Name: diethyl 2-(4-nitro-1H-imidazol-5-yl)propanedioate CAS Name: 2-(4-nitro-1H-imidazol-5-yl)propanedioic acid diethyl ester IUPAC Name: diethyl 2-(4-nitro-1H-imidazol-5-yl)propanedioate Traditional Name: 2-(4-nitro-1H-imidazol-5-yl)malonic acid diethyl ester Formula: C10H13N3O6 MolecularWeight: 271.22672

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C1=C(N=CN1)[N+](=O)[O-])C(=O)OCC

Isomeric SMILES

CCOC(=O)C(C1=C(N=CN1)[N+](=O)[O-])C(=O)OCC

InChI

InChI=1S/C10H13N3O6/c1-3-18-9(14)6(10(15)19-4-2)7-8(13(16)17)12-5-11-7/h5-6H,3-4H2,1-2H3,(H,11,12)