| 種別 | プログラム | バージョン | 表記 |
| SMILES | ACDLabs | 10.04 | [O-][N+](=O)c1ccc(OP(=O)(OCC[N+](C)(C)C)O)cc1 |
| SMILES_CANONICAL | CACTVS | 3.341 | C[N+](C)(C)CCO[P@@](O)(=O)Oc1ccc(cc1)[N+]([O-])=O |
| SMILES | CACTVS | 3.341 | C[N+](C)(C)CCO[P](O)(=O)Oc1ccc(cc1)[N+]([O-])=O |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.5.0 | C[N+](C)(C)CCO[P@](=O)(O)Oc1ccc(cc1)[N+](=O)[O-] |
| SMILES | OpenEye OEToolkits | 1.5.0 | C[N+](C)(C)CCOP(=O)(O)Oc1ccc(cc1)[N+](=O)[O-] |
| InChI | InChI | 1.03 | InChI=1S/C11H17N2O6P/c1-13(2,3)8-9-18-20(16,17)19-11-6-4-10(5-7-11)12(14)15/h4-7H,8-9H2,1-3H3/p+1 |
| InChIKey | InChI | 1.03 | NAIXASFEPQPICN-UHFFFAOYSA-O |
