| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 14.52 | O=C(C(C)c1ccccc1OC)N1CCCC(C1)C(N)=O |
| InChI | InChI | 1.06 | InChI=1S/C16H22N2O3/c1-11(13-7-3-4-8-14(13)21-2)16(20)18-9-5-6-12(10-18)15(17)19/h3-4,7-8,11-12H,5-6,9-10H2,1-2H3,(H2,17,19)/t11-,12+/m1/s1 |
| InChIKey | InChI | 1.06 | PMVJSDCMAGKMNB-NEPJUHHUSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | COc1ccccc1[C@@H](C)C(=O)N2CCC[C@@H](C2)C(N)=O |
| SMILES | CACTVS | 3.385 | COc1ccccc1[CH](C)C(=O)N2CCC[CH](C2)C(N)=O |
| SMILES_CANONICAL | OpenEye OEToolkits | 3.1.0.0 | C[C@H](c1ccccc1OC)C(=O)N2CCC[C@@H](C2)C(=O)N |
| SMILES | OpenEye OEToolkits | 3.1.0.0 | CC(c1ccccc1OC)C(=O)N2CCCC(C2)C(=O)N |
