| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 11.02 | O=C(c1cc(Cl)c(O)cc1O)N3C(c2c(cccc2)C)CCC3 |
| SMILES_CANONICAL | CACTVS | 3.352 | Cc1ccccc1[C@H]2CCCN2C(=O)c3cc(Cl)c(O)cc3O |
| SMILES | CACTVS | 3.352 | Cc1ccccc1[CH]2CCCN2C(=O)c3cc(Cl)c(O)cc3O |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.7.0 | Cc1ccccc1[C@H]2CCCN2C(=O)c3cc(c(cc3O)O)Cl |
| SMILES | OpenEye OEToolkits | 1.7.0 | Cc1ccccc1C2CCCN2C(=O)c3cc(c(cc3O)O)Cl |
| InChI | InChI | 1.03 | InChI=1S/C18H18ClNO3/c1-11-5-2-3-6-12(11)15-7-4-8-20(15)18(23)13-9-14(19)17(22)10-16(13)21/h2-3,5-6,9-10,15,21-22H,4,7-8H2,1H3/t15-/m1/s1 |
| InChIKey | InChI | 1.03 | SOMWPEIBCBZHBS-OAHLLOKOSA-N |
