bis[2-(2-methyl-4-nitro-imidazol-1-yl)ethyl] ethanedioate

Systemtic Name: bis[2-(2-methyl-4-nitro-imidazol-1-yl)ethyl] ethanedioate Openeye Name: bis[2-(2-methyl-4-nitro-imidazol-1-yl)ethyl] oxalate CAS Name: oxalic acid bis[2-(2-methyl-4-nitro-1-imidazolyl)ethyl] ester IUPAC Name: bis[2-(2-methyl-4-nitroimidazol-1-yl)ethyl] oxalate Traditional Name: oxalic acid bis[2-(2-methyl-4-nitro-imidazol-1-yl)ethyl] ester Formula: C14H16N6O8 MolecularWeight: 396.31224

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=CN1CCOC(=O)C(=O)OCCN2C=C(N=C2C)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

CC1=NC(=CN1CCOC(=O)C(=O)OCCN2C=C(N=C2C)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C14H16N6O8/c1-9-15-11(19(23)24)7-17(9)3-5-27-13(21)14(22)28-6-4-18-8-12(20(25)26)16-10(18)2/h7-8H,3-6H2,1-2H3