2-[(4-nitro-1H-imidazol-5-yl)carbonylamino]butanedioic acid

Systemtic Name: 2-[(4-nitro-1H-imidazol-5-yl)carbonylamino]butanedioic acid Openeye Name: 2-[(4-nitro-1H-imidazole-5-carbonyl)amino]butanedioic acid CAS Name: 2-[[(4-nitro-1H-imidazol-5-yl)-oxomethyl]amino]butanedioic acid IUPAC Name: 2-[(4-nitro-1H-imidazole-5-carbonyl)amino]butanedioic acid Traditional Name: 2-[(4-nitro-1H-imidazole-5-carbonyl)amino]succinic acid Formula: C8H8N4O7 MolecularWeight: 272.17172

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C8H8N4O7/c13-4(14)1-3(8(16)17)11-7(15)5-6(12(18)19)10-2-9-5/h2-3H,1H2,(H,9,10)(H,11,15)(H,13,14)(H,16,17)