| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 10.04 | O=C(OC2CCCNCC2NC(=O)c1ccc(O)cc1)c3ccc(O)cc3 |
| SMILES_CANONICAL | CACTVS | 3.341 | Oc1ccc(cc1)C(=O)N[C@@H]2CNCCC[C@H]2OC(=O)c3ccc(O)cc3 |
| SMILES | CACTVS | 3.341 | Oc1ccc(cc1)C(=O)N[CH]2CNCCC[CH]2OC(=O)c3ccc(O)cc3 |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.5.0 | c1cc(ccc1C(=O)N[C@@H]2CNCCC[C@H]2OC(=O)c3ccc(cc3)O)O |
| SMILES | OpenEye OEToolkits | 1.5.0 | c1cc(ccc1C(=O)NC2CNCCCC2OC(=O)c3ccc(cc3)O)O |
| InChI | InChI | 1.03 | InChI=1S/C20H22N2O5/c23-15-7-3-13(4-8-15)19(25)22-17-12-21-11-1-2-18(17)27-20(26)14-5-9-16(24)10-6-14/h3-10,17-18,21,23-24H,1-2,11-12H2,(H,22,25)/t17-,18-/m1/s1 |
| InChIKey | InChI | 1.03 | FZJQHARRQUNVGZ-QZTJIDSGSA-N |
