| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | c4(c1cc(C#N)ccc1OC2CC2c3ccc(cc3F)F)cc(C)nn4 |
| InChI | InChI | 1.03 | InChI=1S/C20H15F2N3O/c1-11-6-18(25-24-11)16-7-12(10-23)2-5-19(16)26-20-9-15(20)14-4-3-13(21)8-17(14)22/h2-8,15,20H,9H2,1H3,(H,24,25)/t15-,20-/m1/s1 |
| InChIKey | InChI | 1.03 | QPKQDLGTZJBNKZ-FOIQADDNSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | Cc1[nH]nc(c1)c2cc(ccc2O[C@@H]3C[C@@H]3c4ccc(F)cc4F)C#N |
| SMILES | CACTVS | 3.385 | Cc1[nH]nc(c1)c2cc(ccc2O[CH]3C[CH]3c4ccc(F)cc4F)C#N |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | Cc1cc(n[nH]1)c2cc(ccc2O[C@@H]3C[C@@H]3c4ccc(cc4F)F)C#N |
| SMILES | OpenEye OEToolkits | 2.0.7 | Cc1cc(n[nH]1)c2cc(ccc2OC3CC3c4ccc(cc4F)F)C#N |
