| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | O=C(Nc1ccc(cc1)C(F)(F)F)C(/C#N)=C(\O)C |
| InChI | InChI | 1.03 | InChI=1S/C12H9F3N2O2/c1-7(18)10(6-16)11(19)17-9-4-2-8(3-5-9)12(13,14)15/h2-5,18H,1H3,(H,17,19)/b10-7- |
| InChIKey | InChI | 1.03 | UTNUDOFZCWSZMS-YFHOEESVSA-N |
| SMILES_CANONICAL | CACTVS | 3.370 | CC(/O)=C(C#N)/C(=O)Nc1ccc(cc1)C(F)(F)F |
| SMILES | CACTVS | 3.370 | CC(O)=C(C#N)C(=O)Nc1ccc(cc1)C(F)(F)F |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.7.6 | C/C(=C(\C#N)/C(=O)Nc1ccc(cc1)C(F)(F)F)/O |
| SMILES | OpenEye OEToolkits | 1.7.6 | CC(=C(C#N)C(=O)Nc1ccc(cc1)C(F)(F)F)O |
