5-nitro-2-(2-oxidanylideneoxolan-3-yl)isoindole-1,3-dione

Systemtic Name: 5-nitro-2-(2-oxidanylideneoxolan-3-yl)isoindole-1,3-dione Openeye Name: 5-nitro-2-(2-oxotetrahydrofuran-3-yl)isoindoline-1,3-dione CAS Name: 5-nitro-2-(2-oxo-3-oxolanyl)isoindole-1,3-dione IUPAC Name: 5-nitro-2-(2-oxooxolan-3-yl)isoindole-1,3-dione Traditional Name: 2-(2-ketotetrahydrofuran-3-yl)-5-nitro-isoindoline-1,3-quinone Formula: C12H8N2O6 MolecularWeight: 276.20172

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Descriptors Computed from Structure

Canonical SMILES:

C1COC(=O)C1N2C(=O)C3=C(C2=O)C=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

C1COC(=O)C1N2C(=O)C3=C(C2=O)C=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C12H8N2O6/c15-10-7-2-1-6(14(18)19)5-8(7)11(16)13(10)9-3-4-20-12(9)17/h1-2,5,9H,3-4H2