6,7-dinitro-3,4-dihydro-2H-1,5-benzodioxepine

Systemtic Name: 6,7-dinitro-3,4-dihydro-2H-1,5-benzodioxepine Openeye Name: 6,7-dinitro-3,4-dihydro-2H-1,5-benzodioxepine CAS Name: 6,7-dinitro-3,4-dihydro-2H-1,5-benzodioxepin IUPAC Name: 6,7-dinitro-3,4-dihydro-2H-1,5-benzodioxepine Traditional Name: 6,7-dinitro-3,4-dihydro-2H-1,5-benzodioxepin Formula: C9H8N2O6 MolecularWeight: 240.16962

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(C(=C(C=C2)[N+](=O)[O-])[N+](=O)[O-])OC1

Isomeric SMILES

C1COC2=C(C(=C(C=C2)[N+](=O)[O-])[N+](=O)[O-])OC1

InChI

InChI=1S/C9H8N2O6/c12-10(13)6-2-3-7-9(8(6)11(14)15)17-5-1-4-16-7/h2-3H,1,4-5H2