methyl 2,7-dinitro-9-oxidanylidene-xanthene-1-carboxylate

Systemtic Name: methyl 2,7-dinitro-9-oxidanylidene-xanthene-1-carboxylate Openeye Name: methyl 2,7-dinitro-9-oxo-xanthene-1-carboxylate CAS Name: 2,7-dinitro-9-oxo-1-xanthenecarboxylic acid methyl ester IUPAC Name: methyl 2,7-dinitro-9-oxoxanthene-1-carboxylate Traditional Name: 9-keto-2,7-dinitro-xanthene-1-carboxylic acid methyl ester Formula: C15H8N2O8 MolecularWeight: 344.23262

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(C=CC2=C1C(=O)C3=C(O2)C=CC(=C3)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

COC(=O)C1=C(C=CC2=C1C(=O)C3=C(O2)C=CC(=C3)[N+](=O)[O-])[N+](=O)[O-]

InChI

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