| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 14.52 | OC1CC(NCCCCCC)C(OCCCCCC)C(O)C1O |
| InChI | InChI | 1.06 | InChI=1S/C18H37NO4/c1-3-5-7-9-11-19-14-13-15(20)16(21)17(22)18(14)23-12-10-8-6-4-2/h14-22H,3-13H2,1-2H3/t14-,15-,16+,17-,18-/m0/s1 |
| InChIKey | InChI | 1.06 | YXVZGHDVIUUBBR-JCECYMMASA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | CCCCCCN[C@H]1C[C@H](O)[C@@H](O)[C@H](O)[C@H]1OCCCCCC |
| SMILES | CACTVS | 3.385 | CCCCCCN[CH]1C[CH](O)[CH](O)[CH](O)[CH]1OCCCCCC |
| SMILES_CANONICAL | OpenEye OEToolkits | 3.1.0.0 | CCCCCCN[C@H]1C[C@@H]([C@H]([C@@H]([C@H]1OCCCCCC)O)O)O |
| SMILES | OpenEye OEToolkits | 3.1.0.0 | CCCCCCNC1CC(C(C(C1OCCCCCC)O)O)O |
