| 種別 | プログラム | バージョン | 表記 |
| SMILES | ACDLabs | 12.01 | OC/C(Cc1ccc(C)cc1)=C/COP(OP(O)(O)=O)(O)=O |
| InChI | InChI | 1.03 | InChI=1S/C12H18O8P2/c1-10-2-4-11(5-3-10)8-12(9-13)6-7-19-22(17,18)20-21(14,15)16/h2-6,13H,7-9H2,1H3,(H,17,18)(H2,14,15,16)/b12-6+ |
| InChIKey | InChI | 1.03 | UZMNPEQMXYMHTH-WUXMJOGZSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | Cc1ccc(CC(\CO)=C/CO[P](O)(=O)O[P](O)(O)=O)cc1 |
| SMILES | CACTVS | 3.385 | Cc1ccc(CC(CO)=CCO[P](O)(=O)O[P](O)(O)=O)cc1 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.6 | Cc1ccc(cc1)C/C(=C\COP(=O)(O)OP(=O)(O)O)/CO |
| SMILES | OpenEye OEToolkits | 2.0.6 | Cc1ccc(cc1)CC(=CCOP(=O)(O)OP(=O)(O)O)CO |
