| 種別 | プログラム | バージョン | 表記 |
| SMILES | ACDLabs | 12.01 | Clc1ccc(cc1)C(Oc2cc(ccc2)C(F)(F)F)C(=O)O |
| InChI | InChI | 1.03 | InChI=1S/C15H10ClF3O3/c16-11-6-4-9(5-7-11)13(14(20)21)22-12-3-1-2-10(8-12)15(17,18)19/h1-8,13H,(H,20,21)/t13-/m1/s1 |
| InChIKey | InChI | 1.03 | DDTQLPXXNHLBAB-CYBMUJFWSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | OC(=O)[C@H](Oc1cccc(c1)C(F)(F)F)c2ccc(Cl)cc2 |
| SMILES | CACTVS | 3.385 | OC(=O)[CH](Oc1cccc(c1)C(F)(F)F)c2ccc(Cl)cc2 |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.7.6 | c1cc(cc(c1)O[C@H](c2ccc(cc2)Cl)C(=O)O)C(F)(F)F |
| SMILES | OpenEye OEToolkits | 1.7.6 | c1cc(cc(c1)OC(c2ccc(cc2)Cl)C(=O)O)C(F)(F)F |
