| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | N#Cc1nc(ccc1)c3ccc(OCCCN2CCN(CC2)C)c(c3)C(F)(F)F |
| SMILES_CANONICAL | CACTVS | 3.370 | CN1CCN(CCCOc2ccc(cc2C(F)(F)F)c3cccc(n3)C#N)CC1 |
| SMILES | CACTVS | 3.370 | CN1CCN(CCCOc2ccc(cc2C(F)(F)F)c3cccc(n3)C#N)CC1 |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.7.0 | CN1CCN(CC1)CCCOc2ccc(cc2C(F)(F)F)c3cccc(n3)C#N |
| SMILES | OpenEye OEToolkits | 1.7.0 | CN1CCN(CC1)CCCOc2ccc(cc2C(F)(F)F)c3cccc(n3)C#N |
| InChI | InChI | 1.03 | InChI=1S/C21H23F3N4O/c1-27-9-11-28(12-10-27)8-3-13-29-20-7-6-16(14-18(20)21(22,23)24)19-5-2-4-17(15-25)26-19/h2,4-7,14H,3,8-13H2,1H3 |
| InChIKey | InChI | 1.03 | CWICZCHZPOSFKO-UHFFFAOYSA-N |
