diethyl (2R)-2-[(4-nitro-1H-imidazol-5-yl)carbonylamino]butanedioate

Systemtic Name: diethyl (2R)-2-[(4-nitro-1H-imidazol-5-yl)carbonylamino]butanedioate Openeye Name: diethyl (2R)-2-[(4-nitro-1H-imidazole-5-carbonyl)amino]butanedioate CAS Name: (2R)-2-[[(4-nitro-1H-imidazol-5-yl)-oxomethyl]amino]butanedioic acid diethyl ester IUPAC Name: diethyl (2R)-2-[(4-nitro-1H-imidazole-5-carbonyl)amino]butanedioate Traditional Name: (2R)-2-[(4-nitro-1H-imidazole-5-carbonyl)amino]succinic acid diethyl ester Formula: C12H16N4O7 MolecularWeight: 328.27804

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H16N4O7/c1-3-22-8(17)5-7(12(19)23-4-2)15-11(18)9-10(16(20)21)14-6-13-9/h6-7H,3-5H2,1-2H3,(H,13,14)(H,15,18)/t7-/m1/s1