5-methoxy-6,7,8-trinitro-2,3-dihydro-1,4-benzodioxine

Systemtic Name: 5-methoxy-6,7,8-trinitro-2,3-dihydro-1,4-benzodioxine Openeye Name: 5-methoxy-6,7,8-trinitro-2,3-dihydro-1,4-benzodioxine CAS Name: 5-methoxy-6,7,8-trinitro-2,3-dihydro-1,4-benzodioxin IUPAC Name: 5-methoxy-6,7,8-trinitro-2,3-dihydro-1,4-benzodioxine Traditional Name: 5-methoxy-6,7,8-trinitro-2,3-dihydro-1,4-benzodioxin Formula: C9H7N3O9 MolecularWeight: 301.16658

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=C(C2=C1OCCO2)[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

COC1=C(C(=C(C2=C1OCCO2)[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C9H7N3O9/c1-19-7-5(11(15)16)4(10(13)14)6(12(17)18)8-9(7)21-3-2-20-8/h2-3H2,1H3