| Type | Program | Version | Descriptor |
| InChI | InChI | 1.06 | InChI=1S/C18H14ClNO7S3/c1-27-18(21)17-15(10-16(28-17)11-5-7-12(19)8-6-11)20-29(22,23)13-3-2-4-14(9-13)30(24,25)26/h2-10,20H,1H3,(H,24,25,26) |
| InChIKey | InChI | 1.06 | MDEJRDZUPXQYRK-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | COC(=O)c1sc(cc1N[S](=O)(=O)c2cccc(c2)[S](O)(=O)=O)c3ccc(Cl)cc3 |
| SMILES | CACTVS | 3.385 | COC(=O)c1sc(cc1N[S](=O)(=O)c2cccc(c2)[S](O)(=O)=O)c3ccc(Cl)cc3 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | COC(=O)c1c(cc(s1)c2ccc(cc2)Cl)NS(=O)(=O)c3cccc(c3)S(=O)(=O)O |
| SMILES | OpenEye OEToolkits | 2.0.7 | COC(=O)c1c(cc(s1)c2ccc(cc2)Cl)NS(=O)(=O)c3cccc(c3)S(=O)(=O)O |
