1-(4,6-dinitrocyclohexa-1,3-dien-1-yl)-2-nitro-benzene

Systemtic Name: 1-(4,6-dinitrocyclohexa-1,3-dien-1-yl)-2-nitro-benzene Openeye Name: 1-(4,6-dinitrocyclohexa-1,3-dien-1-yl)-2-nitro-benzene CAS Name: 1-(4,6-dinitro-1-cyclohexa-1,3-dienyl)-2-nitrobenzene IUPAC Name: 1-(4,6-dinitrocyclohexa-1,3-dien-1-yl)-2-nitrobenzene Traditional Name: 1-(4,6-dinitrocyclohexa-1,3-dien-1-yl)-2-nitro-benzene Formula: C12H9N3O6 MolecularWeight: 291.21636

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Descriptors Computed from Structure

Canonical SMILES:

C1C(C(=CC=C1[N+](=O)[O-])C2=CC=CC=C2[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

C1C(C(=CC=C1[N+](=O)[O-])C2=CC=CC=C2[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C12H9N3O6/c16-13(17)8-5-6-10(12(7-8)15(20)21)9-3-1-2-4-11(9)14(18)19/h1-6,12H,7H2