2-nitro-5-oxidanyl-4H-1,3-benzodioxole-5-carbaldehyde

Systemtic Name: 2-nitro-5-oxidanyl-4H-1,3-benzodioxole-5-carbaldehyde Openeye Name: 5-hydroxy-2-nitro-4H-1,3-benzodioxole-5-carbaldehyde CAS Name: 5-hydroxy-2-nitro-4H-1,3-benzodioxole-5-carboxaldehyde IUPAC Name: 5-hydroxy-2-nitro-4H-1,3-benzodioxole-5-carbaldehyde Traditional Name: 5-hydroxy-2-nitro-4H-1,3-benzodioxole-5-carbaldehyde Formula: C8H7NO6 MolecularWeight: 213.14428

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C2=C(C=CC1(C=O)O)OC(O2)[N+](=O)[O-]

Isomeric SMILES

C1C2=C(C=CC1(C=O)O)OC(O2)[N+](=O)[O-]

InChI

InChI=1S/C8H7NO6/c10-4-8(11)2-1-5-6(3-8)15-7(14-5)9(12)13/h1-2,4,7,11H,3H2