| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | O=C(O)C(NCC(O)C(N)CC(C)C)CCC |
| InChI | InChI | 1.03 | InChI=1S/C12H26N2O3/c1-4-5-10(12(16)17)14-7-11(15)9(13)6-8(2)3/h8-11,14-15H,4-7,13H2,1-3H3,(H,16,17)/t9-,10-,11+/m0/s1 |
| InChIKey | InChI | 1.03 | WENKKRZBAKQUEN-GARJFASQSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | CCC[C@H](NC[C@@H](O)[C@@H](N)CC(C)C)C(O)=O |
| SMILES | CACTVS | 3.385 | CCC[CH](NC[CH](O)[CH](N)CC(C)C)C(O)=O |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.9.2 | CCC[C@@H](C(=O)O)NC[C@H]([C@H](CC(C)C)N)O |
| SMILES | OpenEye OEToolkits | 1.9.2 | CCCC(C(=O)O)NCC(C(CC(C)C)N)O |
