| 種別 | プログラム | バージョン | 表記 |
| SMILES | ACDLabs | 14.52 | O=[N+]([O-])c1ccccc1C(OCC[As+](C)(C)C)C(F)(F)F |
| InChI | InChI | 1.06 | InChI=1S/C13H18AsF3NO3/c1-14(2,3)8-9-21-12(13(15,16)17)10-6-4-5-7-11(10)18(19)20/h4-7,12H,8-9H2,1-3H3/q+1/t12-/m0/s1 |
| InChIKey | InChI | 1.06 | CXESBBIBKWBQOV-LBPRGKRZSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | C[As+](C)(C)CCO[C@@H](c1ccccc1[N+]([O-])=O)C(F)(F)F |
| SMILES | CACTVS | 3.385 | C[As+](C)(C)CCO[CH](c1ccccc1[N+]([O-])=O)C(F)(F)F |
| SMILES_CANONICAL | OpenEye OEToolkits | 3.1.0.0 | C[As+](C)(C)CCO[C@@H](c1ccccc1[N+](=O)[O-])C(F)(F)F |
| SMILES | OpenEye OEToolkits | 3.1.0.0 | C[As+](C)(C)CCOC(c1ccccc1[N+](=O)[O-])C(F)(F)F |
