2,4-dinitro-6-[(2-oxidanylidene-1,3-dihydrobenzimidazol-5-yl)iminomethyl]phenolate

Systemtic Name: 2,4-dinitro-6-[(2-oxidanylidene-1,3-dihydrobenzimidazol-5-yl)iminomethyl]phenolate Openeye Name: 2,4-dinitro-6-[(2-oxo-1,3-dihydrobenzimidazol-5-yl)iminomethyl]phenolate CAS Name: 2,4-dinitro-6-[(2-oxo-1,3-dihydrobenzimidazol-5-yl)iminomethyl]phenolate IUPAC Name: 2,4-dinitro-6-[(2-oxo-1,3-dihydrobenzimidazol-5-yl)iminomethyl]phenolate Traditional Name: 2-[(2-keto-1,3-dihydrobenzimidazol-5-yl)iminomethyl]-4,6-dinitro-phenolate Formula: C14H8N5O6- MolecularWeight: 342.24322

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C1N=CC3=CC(=CC(=C3[O-])[N+](=O)[O-])[N+](=O)[O-])NC(=O)N2

Isomeric SMILES

C1=CC2=C(C=C1N=CC3=CC(=CC(=C3[O-])[N+](=O)[O-])[N+](=O)[O-])NC(=O)N2

InChI

InChI=1S/C14H9N5O6/c20-13-7(3-9(18(22)23)5-12(13)19(24)25)6-15-8-1-2-10-11(4-8)17-14(21)16-10/h1-6,20H,(H2,16,17,21)/p-1