| 種別 | プログラム | バージョン | 表記 |
| SMILES | ACDLabs | 12.01 | O=C(NCCC(=O)NCCCC(=O)CF)C(O)C(C)(C)CO |
| SMILES_CANONICAL | CACTVS | 3.370 | CC(C)(CO)[C@@H](O)C(=O)NCCC(=O)NCCCC(=O)CF |
| SMILES | CACTVS | 3.370 | CC(C)(CO)[CH](O)C(=O)NCCC(=O)NCCCC(=O)CF |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.7.0 | CC(C)(CO)[C@H](C(=O)NCCC(=O)NCCCC(=O)CF)O |
| SMILES | OpenEye OEToolkits | 1.7.0 | CC(C)(CO)C(C(=O)NCCC(=O)NCCCC(=O)CF)O |
| InChI | InChI | 1.03 | InChI=1S/C14H25FN2O5/c1-14(2,9-18)12(21)13(22)17-7-5-11(20)16-6-3-4-10(19)8-15/h12,18,21H,3-9H2,1-2H3,(H,16,20)(H,17,22)/t12-/m0/s1 |
| InChIKey | InChI | 1.03 | FTHCNOQGZZPFFG-LBPRGKRZSA-N |
