| 種別 | プログラム | バージョン | 表記 |
| SMILES | ACDLabs | 10.04 | O=S(=O)(c1cc(c(cc1)N2C(=O)CCC2)[N+]([O-])=O)N |
| SMILES_CANONICAL | CACTVS | 3.341 | N[S](=O)(=O)c1ccc(N2CCCC2=O)c(c1)[N+]([O-])=O |
| SMILES | CACTVS | 3.341 | N[S](=O)(=O)c1ccc(N2CCCC2=O)c(c1)[N+]([O-])=O |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.5.0 | c1cc(c(cc1S(=O)(=O)N)[N+](=O)[O-])N2CCCC2=O |
| SMILES | OpenEye OEToolkits | 1.5.0 | c1cc(c(cc1S(=O)(=O)N)[N+](=O)[O-])N2CCCC2=O |
| InChI | InChI | 1.03 | InChI=1S/C10H11N3O5S/c11-19(17,18)7-3-4-8(9(6-7)13(15)16)12-5-1-2-10(12)14/h3-4,6H,1-2,5H2,(H2,11,17,18) |
| InChIKey | InChI | 1.03 | FPCPYSKJIRSWIG-UHFFFAOYSA-N |
