1-methyl-N-[2-[(1-methyl-4-nitro-imidazol-2-yl)carbonylamino]ethyl]-4-nitro-imidazole-2-carboxamide

Systemtic Name: 1-methyl-N-[2-[(1-methyl-4-nitro-imidazol-2-yl)carbonylamino]ethyl]-4-nitro-imidazole-2-carboxamide Openeye Name: 1-methyl-N-[2-[(1-methyl-4-nitro-imidazole-2-carbonyl)amino]ethyl]-4-nitro-imidazole-2-carboxamide CAS Name: 1-methyl-N-[2-[[(1-methyl-4-nitro-2-imidazolyl)-oxomethyl]amino]ethyl]-4-nitro-2-imidazolecarboxamide IUPAC Name: 1-methyl-N-[2-[(1-methyl-4-nitroimidazole-2-carbonyl)amino]ethyl]-4-nitroimidazole-2-carboxamide Traditional Name: 1-methyl-N-[2-[(1-methyl-4-nitro-imidazole-2-carbonyl)amino]ethyl]-4-nitro-imidazole-2-carboxamide Formula: C12H14N8O6 MolecularWeight: 366.28956

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(N=C1C(=O)NCCNC(=O)C2=NC(=CN2C)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

CN1C=C(N=C1C(=O)NCCNC(=O)C2=NC(=CN2C)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C12H14N8O6/c1-17-5-7(19(23)24)15-9(17)11(21)13-3-4-14-12(22)10-16-8(20(25)26)6-18(10)2/h5-6H,3-4H2,1-2H3,(H,13,21)(H,14,22)