3-methyl-7-nitro-2,4,3-benzodioxazepine-1,5-dione

Systemtic Name: 3-methyl-7-nitro-2,4,3-benzodioxazepine-1,5-dione Openeye Name: 3-methyl-7-nitro-2,4,3-benzodioxazepine-1,5-dione CAS Name: 3-methyl-7-nitro-2,4,3-benzodioxazepine-1,5-dione IUPAC Name: 3-methyl-7-nitro-2,4,3-benzodioxazepine-1,5-dione Traditional Name: 3-methyl-7-nitro-2,4,3-benzodioxazepine-1,5-quinone Formula: C9H6N2O6 MolecularWeight: 238.15374

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Descriptors Computed from Structure

Canonical SMILES:

CN1OC(=O)C2=C(C=C(C=C2)[N+](=O)[O-])C(=O)O1

Isomeric SMILES

CN1OC(=O)C2=C(C=C(C=C2)[N+](=O)[O-])C(=O)O1

InChI

InChI=1S/C9H6N2O6/c1-10-16-8(12)6-3-2-5(11(14)15)4-7(6)9(13)17-10/h2-4H,1H3