[(1E)-1-[(2,4-dinitrophenyl)hydrazinylidene]-2-methyl-propan-2-yl] 3,5-dinitrobenzoate

Systemtic Name: [(1E)-1-[(2,4-dinitrophenyl)hydrazinylidene]-2-methyl-propan-2-yl] 3,5-dinitrobenzoate Openeye Name: [(2E)-2-[(2,4-dinitrophenyl)hydrazono]-1,1-dimethyl-ethyl] 3,5-dinitrobenzoate CAS Name: 3,5-dinitrobenzoic acid [(1E)-1-[(2,4-dinitrophenyl)hydrazinylidene]-2-methylpropan-2-yl] ester IUPAC Name: [(1E)-1-[(2,4-dinitrophenyl)hydrazinylidene]-2-methylpropan-2-yl] 3,5-dinitrobenzoate Traditional Name: 3,5-dinitrobenzoic acid [(2E)-2-[(2,4-dinitrophenyl)hydrazono]-1,1-dimethyl-ethyl] ester Formula: C17H14N6O10 MolecularWeight: 462.32726

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C=NNC1=C(C=C(C=C1)[N+](=O)[O-])[N+](=O)[O-])OC(=O)C2=CC(=CC(=C2)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

CC(C)(/C=N/NC1=C(C=C(C=C1)[N+](=O)[O-])[N+](=O)[O-])OC(=O)C2=CC(=CC(=C2)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C17H14N6O10/c1-17(2,9-18-19-14-4-3-11(20(25)26)8-15(14)23(31)32)33-16(24)10-5-12(21(27)28)7-13(6-10)22(29)30/h3-9,19H,1-2H3/b18-9+