| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | N#Cc1ccc(c(c1)F)Oc2ccc(OC(C)C(O)=O)cc2 |
| InChI | InChI | 1.03 | InChI=1S/C16H12FNO4/c1-10(16(19)20)21-12-3-5-13(6-4-12)22-15-7-2-11(9-18)8-14(15)17/h2-8,10H,1H3,(H,19,20)/t10-/m1/s1 |
| InChIKey | InChI | 1.03 | ROBSGBGTWRRYSK-SNVBAGLBSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | C[C@@H](Oc1ccc(Oc2ccc(cc2F)C#N)cc1)C(O)=O |
| SMILES | CACTVS | 3.385 | C[CH](Oc1ccc(Oc2ccc(cc2F)C#N)cc1)C(O)=O |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | C[C@H](C(=O)O)Oc1ccc(cc1)Oc2ccc(cc2F)C#N |
| SMILES | OpenEye OEToolkits | 2.0.7 | CC(C(=O)O)Oc1ccc(cc1)Oc2ccc(cc2F)C#N |
