2-[(6-nitro-4H-1,3-benzodioxin-8-yl)methyl]isoindole-1,3-dione

Systemtic Name: 2-[(6-nitro-4H-1,3-benzodioxin-8-yl)methyl]isoindole-1,3-dione Openeye Name: 2-[(6-nitro-4H-1,3-benzodioxin-8-yl)methyl]isoindoline-1,3-dione CAS Name: 2-[(6-nitro-4H-1,3-benzodioxin-8-yl)methyl]isoindole-1,3-dione IUPAC Name: 2-[(6-nitro-4H-1,3-benzodioxin-8-yl)methyl]isoindole-1,3-dione Traditional Name: 2-[(6-nitro-4H-1,3-benzodioxin-8-yl)methyl]isoindoline-1,3-quinone Formula: C17H12N2O6 MolecularWeight: 340.28698

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Descriptors Computed from Structure

Canonical SMILES:

C1C2=CC(=CC(=C2OCO1)CN3C(=O)C4=CC=CC=C4C3=O)[N+](=O)[O-]

Isomeric SMILES

C1C2=CC(=CC(=C2OCO1)CN3C(=O)C4=CC=CC=C4C3=O)[N+](=O)[O-]

InChI

InChI=1S/C17H12N2O6/c20-16-13-3-1-2-4-14(13)17(21)18(16)7-10-5-12(19(22)23)6-11-8-24-9-25-15(10)11/h1-6H,7-9H2