6-(4-methoxy-3,5-dinitro-phenyl)-3-methyl-5H-[1,2,4]triazolo[4,3-b][1,2,4]triazole

Systemtic Name: 6-(4-methoxy-3,5-dinitro-phenyl)-3-methyl-5H-[1,2,4]triazolo[4,3-b][1,2,4]triazole Openeye Name: 6-(4-methoxy-3,5-dinitro-phenyl)-3-methyl-5H-[1,2,4]triazolo[4,3-b][1,2,4]triazole CAS Name: 6-(4-methoxy-3,5-dinitrophenyl)-3-methyl-5H-[1,2,4]triazolo[4,3-b][1,2,4]triazole IUPAC Name: 6-(4-methoxy-3,5-dinitrophenyl)-3-methyl-5H-[1,2,4]triazolo[4,3-b][1,2,4]triazole Traditional Name: 6-(4-methoxy-3,5-dinitro-phenyl)-3-methyl-5H-[1,2,4]triazolo[4,3-b][1,2,4]triazole Formula: C11H9N7O5 MolecularWeight: 319.23306

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN=C2N1NC(=N2)C3=CC(=C(C(=C3)[N+](=O)[O-])OC)[N+](=O)[O-]

Isomeric SMILES

CC1=NN=C2N1NC(=N2)C3=CC(=C(C(=C3)[N+](=O)[O-])OC)[N+](=O)[O-]

InChI

InChI=1S/C11H9N7O5/c1-5-13-14-11-12-10(15-16(5)11)6-3-7(17(19)20)9(23-2)8(4-6)18(21)22/h3-4H,1-2H3,(H,12,14,15)