| 種別 | プログラム | バージョン | 表記 |
| SMILES | ACDLabs | 10.04 | O=[N+]([O-])c1cc(cc([N+]([O-])=O)c1O)[N+]([O-])=O |
| SMILES_CANONICAL | CACTVS | 3.341 | Oc1c(cc(cc1[N+]([O-])=O)[N+]([O-])=O)[N+]([O-])=O |
| SMILES | CACTVS | 3.341 | Oc1c(cc(cc1[N+]([O-])=O)[N+]([O-])=O)[N+]([O-])=O |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.5.0 | c1c(cc(c(c1[N+](=O)[O-])O)[N+](=O)[O-])[N+](=O)[O-] |
| SMILES | OpenEye OEToolkits | 1.5.0 | c1c(cc(c(c1[N+](=O)[O-])O)[N+](=O)[O-])[N+](=O)[O-] |
| InChI | InChI | 1.03 | InChI=1S/C6H3N3O7/c10-6-4(8(13)14)1-3(7(11)12)2-5(6)9(15)16/h1-2,10H |
| InChIKey | InChI | 1.03 | OXNIZHLAWKMVMX-UHFFFAOYSA-N |
