7,8-dimethyl-6-nitro-3-(oxidanylamino)-1H-1,4-benzodiazepine-2,5-dione

Systemtic Name: 7,8-dimethyl-6-nitro-3-(oxidanylamino)-1H-1,4-benzodiazepine-2,5-dione Openeye Name: 3-(hydroxyamino)-7,8-dimethyl-6-nitro-1H-1,4-benzodiazepine-2,5-dione CAS Name: 3-(hydroxyamino)-7,8-dimethyl-6-nitro-1H-1,4-benzodiazepine-2,5-dione IUPAC Name: 3-(hydroxyamino)-7,8-dimethyl-6-nitro-1H-1,4-benzodiazepine-2,5-dione Traditional Name: 3-(hydroxyamino)-7,8-dimethyl-6-nitro-1H-1,4-benzodiazepine-2,5-quinone Formula: C11H10N4O5 MolecularWeight: 278.2209

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C(=C1C)[N+](=O)[O-])C(=O)N=C(C(=O)N2)NO

Isomeric SMILES

CC1=CC2=C(C(=C1C)[N+](=O)[O-])C(=O)N=C(C(=O)N2)NO

InChI

InChI=1S/C11H10N4O5/c1-4-3-6-7(8(5(4)2)15(19)20)10(16)13-9(14-18)11(17)12-6/h3,18H,1-2H3,(H2,12,13,14,16,17)