| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 14.52 | CC(=O)Nc1ccc(cc1)OC1CC(C2CN(CC21)C(=O)CC)c1cccc(Cl)c1 |
| InChI | InChI | 1.06 | InChI=1S/C24H27ClN2O3/c1-3-24(29)27-13-21-20(16-5-4-6-17(25)11-16)12-23(22(21)14-27)30-19-9-7-18(8-10-19)26-15(2)28/h4-11,20-23H,3,12-14H2,1-2H3,(H,26,28)/t20-,21-,22-,23-/m1/s1 |
| InChIKey | InChI | 1.06 | BEXJJYBHLWEKDU-SSGKUCQKSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | CCC(=O)N1C[C@H]2[C@@H](C[C@@H]([C@H]2C1)c3cccc(Cl)c3)Oc4ccc(NC(C)=O)cc4 |
| SMILES | CACTVS | 3.385 | CCC(=O)N1C[CH]2[CH](C[CH]([CH]2C1)c3cccc(Cl)c3)Oc4ccc(NC(C)=O)cc4 |
| SMILES_CANONICAL | OpenEye OEToolkits | 3.1.0.0 | CCC(=O)N1C[C@@H]2[C@H](C[C@H]([C@@H]2C1)Oc3ccc(cc3)NC(=O)C)c4cccc(c4)Cl |
| SMILES | OpenEye OEToolkits | 3.1.0.0 | CCC(=O)N1CC2C(CC(C2C1)Oc3ccc(cc3)NC(=O)C)c4cccc(c4)Cl |
