methyl 2,7-dinitro-9-oxidanylidene-xanthene-3-carboxylate

Systemtic Name: methyl 2,7-dinitro-9-oxidanylidene-xanthene-3-carboxylate Openeye Name: methyl 2,7-dinitro-9-oxo-xanthene-3-carboxylate CAS Name: 2,7-dinitro-9-oxo-3-xanthenecarboxylic acid methyl ester IUPAC Name: methyl 2,7-dinitro-9-oxoxanthene-3-carboxylate Traditional Name: 9-keto-2,7-dinitro-xanthene-3-carboxylic acid methyl ester Formula: C15H8N2O8 MolecularWeight: 344.23262

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(C=C2C(=C1)OC3=C(C2=O)C=C(C=C3)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

COC(=O)C1=C(C=C2C(=C1)OC3=C(C2=O)C=C(C=C3)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C15H8N2O8/c1-24-15(19)8-6-13-10(5-11(8)17(22)23)14(18)9-4-7(16(20)21)2-3-12(9)25-13/h2-6H,1H3