| 種別 | プログラム | バージョン | 表記 |
| SMILES | ACDLabs | 12.01 | Fc1cc(COc2ccc(cc2)Oc2ccc(cc2N)OCC)c(F)cc1 |
| InChI | InChI | 1.06 | InChI=1S/C21H19F2NO3/c1-2-25-18-8-10-21(20(24)12-18)27-17-6-4-16(5-7-17)26-13-14-11-15(22)3-9-19(14)23/h3-12H,2,13,24H2,1H3 |
| InChIKey | InChI | 1.06 | YSUBLPUJDOWYDP-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | CCOc1ccc(Oc2ccc(OCc3cc(F)ccc3F)cc2)c(N)c1 |
| SMILES | CACTVS | 3.385 | CCOc1ccc(Oc2ccc(OCc3cc(F)ccc3F)cc2)c(N)c1 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | CCOc1ccc(c(c1)N)Oc2ccc(cc2)OCc3cc(ccc3F)F |
| SMILES | OpenEye OEToolkits | 2.0.7 | CCOc1ccc(c(c1)N)Oc2ccc(cc2)OCc3cc(ccc3F)F |
