| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | O=C(CC/C=C/C/C=C/C)C1OC1C(=O)N |
| InChI | InChI | 1.03 | InChI=1S/C12H17NO3/c1-2-3-4-5-6-7-8-9(14)10-11(16-10)12(13)15/h2-3,5-6,10-11H,4,7-8H2,1H3,(H2,13,15)/b3-2+,6-5+/t10-,11-/m1/s1 |
| InChIKey | InChI | 1.03 | GVEZIHKRYBHEFX-NQQPLRFYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | C\C=C\C/C=C/CCC(=O)[C@H]1O[C@H]1C(N)=O |
| SMILES | CACTVS | 3.385 | CC=CCC=CCCC(=O)[CH]1O[CH]1C(N)=O |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.7.6 | C/C=C/C/C=C/CCC(=O)[C@@H]1[C@@H](O1)C(=O)N |
| SMILES | OpenEye OEToolkits | 1.7.6 | CC=CCC=CCCC(=O)C1C(O1)C(=O)N |
