| Type | Program | Version | Descriptor |
| InChI | InChI | 1.06 | InChI=1S/C19H21N3O7S/c1-12(23)20-14-2-4-15(5-3-14)30(28,29)22-8-6-21(7-9-22)19(27)13-10-16(24)18(26)17(25)11-13/h2-5,10-11,24-26H,6-9H2,1H3,(H,20,23) |
| InChIKey | InChI | 1.06 | NFOKZCLOJWTFRN-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | CC(=O)Nc1ccc(cc1)[S](=O)(=O)N2CCN(CC2)C(=O)c3cc(O)c(O)c(O)c3 |
| SMILES | CACTVS | 3.385 | CC(=O)Nc1ccc(cc1)[S](=O)(=O)N2CCN(CC2)C(=O)c3cc(O)c(O)c(O)c3 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | CC(=O)Nc1ccc(cc1)S(=O)(=O)N2CCN(CC2)C(=O)c3cc(c(c(c3)O)O)O |
| SMILES | OpenEye OEToolkits | 2.0.7 | CC(=O)Nc1ccc(cc1)S(=O)(=O)N2CCN(CC2)C(=O)c3cc(c(c(c3)O)O)O |
