8-nitro-1,3,4,6-tetrahydro-1,6-benzodiazocine-2,5-dione

Systemtic Name: 8-nitro-1,3,4,6-tetrahydro-1,6-benzodiazocine-2,5-dione Openeye Name: 8-nitro-1,3,4,6-tetrahydro-1,6-benzodiazocine-2,5-dione CAS Name: 8-nitro-1,3,4,6-tetrahydro-1,6-benzodiazocine-2,5-dione IUPAC Name: 8-nitro-1,3,4,6-tetrahydro-1,6-benzodiazocine-2,5-dione Traditional Name: 8-nitro-1,3,4,6-tetrahydro-1,6-benzodiazocine-2,5-quinone Formula: C10H9N3O4 MolecularWeight: 235.19616

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(=O)NC2=C(C=CC(=C2)[N+](=O)[O-])NC1=O

Isomeric SMILES

C1CC(=O)NC2=C(C=CC(=C2)[N+](=O)[O-])NC1=O

InChI

InChI=1S/C10H9N3O4/c14-9-3-4-10(15)12-8-5-6(13(16)17)1-2-7(8)11-9/h1-2,5H,3-4H2,(H,11,14)(H,12,15)