N-[(E)-1-(4,5-dinitro-1-oxidanidyl-1,2,3-triazol-1-ium-2-yl)propan-2-ylideneamino]-2,4-dinitro-aniline

Systemtic Name: N-[(E)-1-(4,5-dinitro-1-oxidanidyl-1,2,3-triazol-1-ium-2-yl)propan-2-ylideneamino]-2,4-dinitro-aniline Openeye Name: N-[(E)-[2-(4,5-dinitro-1-oxido-triazol-1-ium-2-yl)-1-methyl-ethylidene]amino]-2,4-dinitro-aniline CAS Name: N-[(E)-1-(4,5-dinitro-1-oxido-2-triazol-1-iumyl)propan-2-ylideneamino]-2,4-dinitroaniline IUPAC Name: N-[(E)-1-(4,5-dinitro-1-oxidotriazol-1-ium-2-yl)propan-2-ylideneamino]-2,4-dinitroaniline Traditional Name: [(E)-[2-(4,5-dinitro-1-oxido-triazol-1-ium-2-yl)-1-methyl-ethylidene]amino]-(2,4-dinitrophenyl)amine Formula: C11H9N9O9 MolecularWeight: 411.24406

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Descriptors Computed from Structure

Canonical SMILES:

CC(=NNC1=C(C=C(C=C1)[N+](=O)[O-])[N+](=O)[O-])CN2N=C(C(=[N+]2[O-])[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

C/C(=N\NC1=C(C=C(C=C1)[N+](=O)[O-])[N+](=O)[O-])/CN2N=C(C(=[N+]2[O-])[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C11H9N9O9/c1-6(5-15-14-10(19(26)27)11(16(15)21)20(28)29)12-13-8-3-2-7(17(22)23)4-9(8)18(24)25/h2-4,13H,5H2,1H3/b12-6+