4,7-dinitro-9-oxidanylidene-xanthene-2-carboxylic acid

Systemtic Name: 4,7-dinitro-9-oxidanylidene-xanthene-2-carboxylic acid Openeye Name: 4,7-dinitro-9-oxo-xanthene-2-carboxylic acid CAS Name: 4,7-dinitro-9-oxo-2-xanthenecarboxylic acid IUPAC Name: 4,7-dinitro-9-oxoxanthene-2-carboxylic acid Traditional Name: 9-keto-4,7-dinitro-xanthene-2-carboxylic acid Formula: C14H6N2O8 MolecularWeight: 330.20604

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C1[N+](=O)[O-])C(=O)C3=CC(=CC(=C3O2)[N+](=O)[O-])C(=O)O

Isomeric SMILES

C1=CC2=C(C=C1[N+](=O)[O-])C(=O)C3=CC(=CC(=C3O2)[N+](=O)[O-])C(=O)O

InChI

InChI=1S/C14H6N2O8/c17-12-8-5-7(15(20)21)1-2-11(8)24-13-9(12)3-6(14(18)19)4-10(13)16(22)23/h1-5H,(H,18,19)