4-[(5,7-dinitro-1,3-dihydro-2,1,3-benzoxadiazol-4-yl)imino]cyclohexa-2,5-dien-1-one

Systemtic Name: 4-[(5,7-dinitro-1,3-dihydro-2,1,3-benzoxadiazol-4-yl)imino]cyclohexa-2,5-dien-1-one Openeye Name: 4-[(5,7-dinitro-1,3-dihydro-2,1,3-benzoxadiazol-4-yl)imino]cyclohexa-2,5-dien-1-one CAS Name: 4-[(5,7-dinitro-1,3-dihydro-2,1,3-benzoxadiazol-4-yl)imino]-1-cyclohexa-2,5-dienone IUPAC Name: 4-[(5,7-dinitro-1,3-dihydro-2,1,3-benzoxadiazol-4-yl)imino]cyclohexa-2,5-dien-1-one Traditional Name: 4-[(5,7-dinitro-1,3-dihydrobenzofurazan-4-yl)imino]cyclohexa-2,5-dien-1-one Formula: C12H7N5O6 MolecularWeight: 317.21388

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=O)C=CC1=NC2=C3C(=C(C=C2[N+](=O)[O-])[N+](=O)[O-])NON3

Isomeric SMILES

C1=CC(=O)C=CC1=NC2=C3C(=C(C=C2[N+](=O)[O-])[N+](=O)[O-])NON3

InChI

InChI=1S/C12H7N5O6/c18-7-3-1-6(2-4-7)13-10-8(16(19)20)5-9(17(21)22)11-12(10)15-23-14-11/h1-5,14-15H