methyl 2-[[1-methyl-4-[(1-methyl-4-nitro-imidazol-2-yl)carbonylamino]imidazol-2-yl]carbonylamino]ethanoate

Systemtic Name: methyl 2-[[1-methyl-4-[(1-methyl-4-nitro-imidazol-2-yl)carbonylamino]imidazol-2-yl]carbonylamino]ethanoate Openeye Name: methyl 2-[[1-methyl-4-[(1-methyl-4-nitro-imidazole-2-carbonyl)amino]imidazole-2-carbonyl]amino]acetate CAS Name: 2-[[[1-methyl-4-[[(1-methyl-4-nitro-2-imidazolyl)-oxomethyl]amino]-2-imidazolyl]-oxomethyl]amino]acetic acid methyl ester IUPAC Name: methyl 2-[[1-methyl-4-[(1-methyl-4-nitroimidazole-2-carbonyl)amino]imidazole-2-carbonyl]amino]acetate Traditional Name: 2-[[1-methyl-4-[(1-methyl-4-nitro-imidazole-2-carbonyl)amino]imidazole-2-carbonyl]amino]acetic acid methyl ester Formula: C13H15N7O6 MolecularWeight: 365.3015

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H15N7O6/c1-18-5-7(15-10(18)12(22)14-4-9(21)26-3)16-13(23)11-17-8(20(24)25)6-19(11)2/h5-6H,4H2,1-3H3,(H,14,22)(H,16,23)