[2-[(3-nitrophenyl)amino]-2-oxidanylidene-ethyl] 4-azanyl-1,2,5-oxadiazole-3-carboxylate

Systemtic Name: [2-[(3-nitrophenyl)amino]-2-oxidanylidene-ethyl] 4-azanyl-1,2,5-oxadiazole-3-carboxylate Openeye Name: [2-(3-nitroanilino)-2-oxo-ethyl] 4-amino-1,2,5-oxadiazole-3-carboxylate CAS Name: 4-amino-1,2,5-oxadiazole-3-carboxylic acid [2-(3-nitroanilino)-2-oxoethyl] ester IUPAC Name: [2-(3-nitroanilino)-2-oxoethyl] 4-amino-1,2,5-oxadiazole-3-carboxylate Traditional Name: 4-aminofurazan-3-carboxylic acid [2-keto-2-(3-nitroanilino)ethyl] ester Formula: C11H9N5O6 MolecularWeight: 307.21906

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)[N+](=O)[O-])NC(=O)COC(=O)C2=NON=C2N

Isomeric SMILES

C1=CC(=CC(=C1)[N+](=O)[O-])NC(=O)COC(=O)C2=NON=C2N

InChI

InChI=1S/C11H9N5O6/c12-10-9(14-22-15-10)11(18)21-5-8(17)13-6-2-1-3-7(4-6)16(19)20/h1-4H,5H2,(H2,12,15)(H,13,17)