6,7-dinitro-3',6'-bis(oxidanyl)spiro[2-benzofuran-3,9'-xanthene]-1-one

Systemtic Name: 6,7-dinitro-3',6'-bis(oxidanyl)spiro[2-benzofuran-3,9'-xanthene]-1-one Openeye Name: 3',6'-dihydroxy-6,7-dinitro-spiro[isobenzofuran-3,9'-xanthene]-1-one CAS Name: 3',6'-dihydroxy-6,7-dinitro-1-spiro[isobenzofuran-3,9'-xanthene]one IUPAC Name: 3',6'-dihydroxy-6,7-dinitrospiro[2-benzofuran-3,9'-xanthene]-1-one Traditional Name: 3',6'-dihydroxy-6,7-dinitro-spiro[phthalan-3,9'-xanthene]-1-one Formula: C20H10N2O9 MolecularWeight: 422.3014

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C1O)OC3=C(C24C5=C(C(=C(C=C5)[N+](=O)[O-])[N+](=O)[O-])C(=O)O4)C=CC(=C3)O

Isomeric SMILES

C1=CC2=C(C=C1O)OC3=C(C24C5=C(C(=C(C=C5)[N+](=O)[O-])[N+](=O)[O-])C(=O)O4)C=CC(=C3)O

InChI

InChI=1S/C20H10N2O9/c23-9-1-3-11-15(7-9)30-16-8-10(24)2-4-12(16)20(11)13-5-6-14(21(26)27)18(22(28)29)17(13)19(25)31-20/h1-8,23-24H