2-(2-nitrophenoxy)-N-[(E)-1-(3-nitro-1,2,4-triazol-1-yl)propan-2-ylideneamino]ethanamide

Systemtic Name: 2-(2-nitrophenoxy)-N-[(E)-1-(3-nitro-1,2,4-triazol-1-yl)propan-2-ylideneamino]ethanamide Openeye Name: N-[(E)-[1-methyl-2-(3-nitro-1,2,4-triazol-1-yl)ethylidene]amino]-2-(2-nitrophenoxy)acetamide CAS Name: 2-(2-nitrophenoxy)-N-[(E)-1-(3-nitro-1,2,4-triazol-1-yl)propan-2-ylideneamino]acetamide IUPAC Name: 2-(2-nitrophenoxy)-N-[(E)-1-(3-nitro-1,2,4-triazol-1-yl)propan-2-ylideneamino]acetamide Traditional Name: N-[(E)-[1-methyl-2-(3-nitro-1,2,4-triazol-1-yl)ethylidene]amino]-2-(2-nitrophenoxy)acetamide Formula: C13H13N7O6 MolecularWeight: 363.28562

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Descriptors Computed from Structure

Canonical SMILES:

CC(=NNC(=O)COC1=CC=CC=C1[N+](=O)[O-])CN2C=NC(=N2)[N+](=O)[O-]

Isomeric SMILES

C/C(=N\NC(=O)COC1=CC=CC=C1[N+](=O)[O-])/CN2C=NC(=N2)[N+](=O)[O-]

InChI

InChI=1S/C13H13N7O6/c1-9(6-18-8-14-13(17-18)20(24)25)15-16-12(21)7-26-11-5-3-2-4-10(11)19(22)23/h2-5,8H,6-7H2,1H3,(H,16,21)/b15-9+