| 種別 | プログラム | バージョン | 表記 |
| SMILES | ACDLabs | 10.04 | [O-][N+](=O)c1c(cc(c(c1)[N+]([O-])=O)N2CC2)C(=O)N |
| SMILES_CANONICAL | CACTVS | 3.341 | NC(=O)c1cc(N2CC2)c(cc1[N+]([O-])=O)[N+]([O-])=O |
| SMILES | CACTVS | 3.341 | NC(=O)c1cc(N2CC2)c(cc1[N+]([O-])=O)[N+]([O-])=O |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.5.0 | c1c(c(cc(c1N2CC2)[N+](=O)[O-])[N+](=O)[O-])C(=O)N |
| SMILES | OpenEye OEToolkits | 1.5.0 | c1c(c(cc(c1N2CC2)[N+](=O)[O-])[N+](=O)[O-])C(=O)N |
| InChI | InChI | 1.03 | InChI=1S/C9H8N4O5/c10-9(14)5-3-7(11-1-2-11)8(13(17)18)4-6(5)12(15)16/h3-4H,1-2H2,(H2,10,14) |
| InChIKey | InChI | 1.03 | WOCXQMCIOTUMJV-UHFFFAOYSA-N |
