| 種別 | プログラム | バージョン | 表記 |
| SMILES | ACDLabs | 12.01 | FC(F)(F)c1cc(CCCN(C)C)cc(c1)CCc2nc(N)cc(c2)C |
| InChI | InChI | 1.03 | InChI=1S/C20H26F3N3/c1-14-9-18(25-19(24)10-14)7-6-16-11-15(5-4-8-26(2)3)12-17(13-16)20(21,22)23/h9-13H,4-8H2,1-3H3,(H2,24,25) |
| InChIKey | InChI | 1.03 | CTKGSJUPWJLHAK-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | CN(C)CCCc1cc(CCc2cc(C)cc(N)n2)cc(c1)C(F)(F)F |
| SMILES | CACTVS | 3.385 | CN(C)CCCc1cc(CCc2cc(C)cc(N)n2)cc(c1)C(F)(F)F |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.6 | Cc1cc(nc(c1)N)CCc2cc(cc(c2)C(F)(F)F)CCCN(C)C |
| SMILES | OpenEye OEToolkits | 2.0.6 | Cc1cc(nc(c1)N)CCc2cc(cc(c2)C(F)(F)F)CCCN(C)C |
