7,8-dimethyl-3,6-dinitro-3,4-dihydro-1H-1,4-benzodiazepine-2,5-dione

Systemtic Name: 7,8-dimethyl-3,6-dinitro-3,4-dihydro-1H-1,4-benzodiazepine-2,5-dione Openeye Name: 7,8-dimethyl-3,6-dinitro-3,4-dihydro-1H-1,4-benzodiazepine-2,5-dione CAS Name: 7,8-dimethyl-3,6-dinitro-3,4-dihydro-1H-1,4-benzodiazepine-2,5-dione IUPAC Name: 7,8-dimethyl-3,6-dinitro-3,4-dihydro-1H-1,4-benzodiazepine-2,5-dione Traditional Name: 7,8-dimethyl-3,6-dinitro-3,4-dihydro-1H-1,4-benzodiazepine-2,5-quinone Formula: C11H10N4O6 MolecularWeight: 294.2203

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C(=C1C)[N+](=O)[O-])C(=O)NC(C(=O)N2)[N+](=O)[O-]

Isomeric SMILES

CC1=CC2=C(C(=C1C)[N+](=O)[O-])C(=O)NC(C(=O)N2)[N+](=O)[O-]

InChI

InChI=1S/C11H10N4O6/c1-4-3-6-7(8(5(4)2)14(18)19)10(16)13-9(15(20)21)11(17)12-6/h3,9H,1-2H3,(H,12,17)(H,13,16)