2-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-nitro-isoindole-1,3-dione

Systemtic Name: 2-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-nitro-isoindole-1,3-dione Openeye Name: 2-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-nitro-isoindoline-1,3-dione CAS Name: 2-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-nitroisoindole-1,3-dione IUPAC Name: 2-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-nitroisoindole-1,3-dione Traditional Name: 2-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-nitro-isoindoline-1,3-quinone Formula: C16H10N2O6 MolecularWeight: 326.2604

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(O1)C=CC(=C2)N3C(=O)C4=C(C3=O)C(=CC=C4)[N+](=O)[O-]

Isomeric SMILES

C1COC2=C(O1)C=CC(=C2)N3C(=O)C4=C(C3=O)C(=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C16H10N2O6/c19-15-10-2-1-3-11(18(21)22)14(10)16(20)17(15)9-4-5-12-13(8-9)24-7-6-23-12/h1-5,8H,6-7H2