N-(2-cyanoaziridin-1-yl)carbonyl-1-methyl-5-nitro-imidazole-2-carboxamide

Systemtic Name: N-(2-cyanoaziridin-1-yl)carbonyl-1-methyl-5-nitro-imidazole-2-carboxamide Openeye Name: N-(2-cyanoaziridine-1-carbonyl)-1-methyl-5-nitro-imidazole-2-carboxamide CAS Name: N-[(2-cyano-1-aziridinyl)-oxomethyl]-1-methyl-5-nitro-2-imidazolecarboxamide IUPAC Name: N-(2-cyanoaziridine-1-carbonyl)-1-methyl-5-nitroimidazole-2-carboxamide Traditional Name: N-(2-cyanoethylenimine-1-carbonyl)-1-methyl-5-nitro-imidazole-2-carboxamide Formula: C9H8N6O4 MolecularWeight: 264.19762

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=CN=C1C(=O)NC(=O)N2CC2C#N)[N+](=O)[O-]

Isomeric SMILES

CN1C(=CN=C1C(=O)NC(=O)N2CC2C#N)[N+](=O)[O-]

InChI

InChI=1S/C9H8N6O4/c1-13-6(15(18)19)3-11-7(13)8(16)12-9(17)14-4-5(14)2-10/h3,5H,4H2,1H3,(H,12,16,17)