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

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

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)OC23C4=CC(=C(C=C4OC5=CC(=C(C=C35)[N+](=O)[O-])O)O)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)OC23C4=CC(=C(C=C4OC5=CC(=C(C=C35)[N+](=O)[O-])O)O)[N+](=O)[O-]

InChI

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