| 種別 | プログラム | バージョン | 表記 |
| SMILES | ACDLabs | 12.01 | [N-]=[N+]=N\CCCP(=O)(OCCCCCCCCCCCCCC)O |
| InChI | InChI | 1.03 | InChI=1S/C17H36N3O3P/c1-2-3-4-5-6-7-8-9-10-11-12-13-16-23-24(21,22)17-14-15-19-20-18/h2-17H2,1H3,(H,21,22) |
| InChIKey | InChI | 1.03 | VPIQHARZTFLBCM-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.370 | CCCCCCCCCCCCCCO[P](O)(=O)CCCN=[N+]=[N-] |
| SMILES | CACTVS | 3.370 | CCCCCCCCCCCCCCO[P](O)(=O)CCCN=[N+]=[N-] |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.7.6 | CCCCCCCCCCCCCCO[P@@](=O)(CCCN=[N+]=[N-])O |
| SMILES | OpenEye OEToolkits | 1.7.6 | CCCCCCCCCCCCCCOP(=O)(CCCN=[N+]=[N-])O |
