| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 10.04 | O=C(NC(C(=O)NC(C#N)COCc1ccccc1)CC(C)C)N2CCOCC2 |
| SMILES_CANONICAL | CACTVS | 3.341 | CC(C)C[C@H](NC(=O)N1CCOCC1)C(=O)N[C@@H](COCc2ccccc2)C#N |
| SMILES | CACTVS | 3.341 | CC(C)C[CH](NC(=O)N1CCOCC1)C(=O)N[CH](COCc2ccccc2)C#N |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.5.0 | CC(C)C[C@@H](C(=O)N[C@@H](COCc1ccccc1)C#N)NC(=O)N2CCOCC2 |
| SMILES | OpenEye OEToolkits | 1.5.0 | CC(C)CC(C(=O)NC(COCc1ccccc1)C#N)NC(=O)N2CCOCC2 |
| InChI | InChI | 1.03 | InChI=1S/C21H30N4O4/c1-16(2)12-19(24-21(27)25-8-10-28-11-9-25)20(26)23-18(13-22)15-29-14-17-6-4-3-5-7-17/h3-7,16,18-19H,8-12,14-15H2,1-2H3,(H,23,26)(H,24,27)/t18-,19+/m1/s1 |
| InChIKey | InChI | 1.03 | LXEDKIMJQBOMSU-MOPGFXCFSA-N |
