4-nitro-2-[(E)-[2-(2-nitrophenyl)-5-oxidanylidene-1,3-oxazol-4-ylidene]methyl]phenolate

Systemtic Name: 4-nitro-2-[(E)-[2-(2-nitrophenyl)-5-oxidanylidene-1,3-oxazol-4-ylidene]methyl]phenolate Openeye Name: 4-nitro-2-[(E)-[2-(2-nitrophenyl)-5-oxo-oxazol-4-ylidene]methyl]phenolate CAS Name: 4-nitro-2-[(E)-[2-(2-nitrophenyl)-5-oxo-4-oxazolylidene]methyl]phenolate IUPAC Name: 4-nitro-2-[(E)-[2-(2-nitrophenyl)-5-oxo-1,3-oxazol-4-ylidene]methyl]phenolate Traditional Name: 2-[(E)-[5-keto-2-(2-nitrophenyl)-2-oxazolin-4-ylidene]methyl]-4-nitro-phenolate Formula: C16H8N3O7- MolecularWeight: 354.25062

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C2=NC(=CC3=C(C=CC(=C3)[N+](=O)[O-])[O-])C(=O)O2)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C(=C1)C2=N/C(=C/C3=C(C=CC(=C3)[N+](=O)[O-])[O-])/C(=O)O2)[N+](=O)[O-]

InChI

InChI=1S/C16H9N3O7/c20-14-6-5-10(18(22)23)7-9(14)8-12-16(21)26-15(17-12)11-3-1-2-4-13(11)19(24)25/h1-8,20H/p-1/b12-8+