| 種別 | プログラム | バージョン | 表記 |
| SMILES | ACDLabs | 12.01 | FC(F)c1cc(CCc2cc(CCN(C)C)cc(F)c2F)nc(N)c1 |
| InChI | InChI | 1.06 | InChI=1S/C18H21F4N3/c1-25(2)6-5-11-7-12(17(20)15(19)8-11)3-4-14-9-13(18(21)22)10-16(23)24-14/h7-10,18H,3-6H2,1-2H3,(H2,23,24) |
| InChIKey | InChI | 1.06 | MBNBALAHMQJWSW-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | CN(C)CCc1cc(F)c(F)c(CCc2cc(cc(N)n2)C(F)F)c1 |
| SMILES | CACTVS | 3.385 | CN(C)CCc1cc(F)c(F)c(CCc2cc(cc(N)n2)C(F)F)c1 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | CN(C)CCc1cc(c(c(c1)F)F)CCc2cc(cc(n2)N)C(F)F |
| SMILES | OpenEye OEToolkits | 2.0.7 | CN(C)CCc1cc(c(c(c1)F)F)CCc2cc(cc(n2)N)C(F)F |
