2,6-dinitro-1,3-benzodioxole-5-carbaldehyde

Systemtic Name: 2,6-dinitro-1,3-benzodioxole-5-carbaldehyde Openeye Name: 2,6-dinitro-1,3-benzodioxole-5-carbaldehyde CAS Name: 2,6-dinitro-1,3-benzodioxole-5-carboxaldehyde IUPAC Name: 2,6-dinitro-1,3-benzodioxole-5-carbaldehyde Traditional Name: 2,6-dinitropiperonal Formula: C8H4N2O7 MolecularWeight: 240.12656

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(C(=CC2=C1OC(O2)[N+](=O)[O-])[N+](=O)[O-])C=O

Isomeric SMILES

C1=C(C(=CC2=C1OC(O2)[N+](=O)[O-])[N+](=O)[O-])C=O

InChI

InChI=1S/C8H4N2O7/c11-3-4-1-6-7(2-5(4)9(12)13)17-8(16-6)10(14)15/h1-3,8H