| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 14.52 | O=S(=O)(c1ccc(OC)cc1)N1CCN(CC1C(=O)NCc1ccc(OC)cc1)C(=O)CCl |
| InChI | InChI | 1.06 | InChI=1S/C22H26ClN3O6S/c1-31-17-5-3-16(4-6-17)14-24-22(28)20-15-25(21(27)13-23)11-12-26(20)33(29,30)19-9-7-18(32-2)8-10-19/h3-10,20H,11-15H2,1-2H3,(H,24,28)/t20-/m1/s1 |
| InChIKey | InChI | 1.06 | SXQZEMXQTRNLRZ-HXUWFJFHSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | COc1ccc(CNC(=O)[C@H]2CN(CCN2[S](=O)(=O)c3ccc(OC)cc3)C(=O)CCl)cc1 |
| SMILES | CACTVS | 3.385 | COc1ccc(CNC(=O)[CH]2CN(CCN2[S](=O)(=O)c3ccc(OC)cc3)C(=O)CCl)cc1 |
| SMILES_CANONICAL | OpenEye OEToolkits | 3.1.0.0 | COc1ccc(cc1)CNC(=O)[C@H]2CN(CCN2S(=O)(=O)c3ccc(cc3)OC)C(=O)CCl |
| SMILES | OpenEye OEToolkits | 3.1.0.0 | COc1ccc(cc1)CNC(=O)C2CN(CCN2S(=O)(=O)c3ccc(cc3)OC)C(=O)CCl |
