| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 10.04 | O=C(O)c2sc(c1ccccc1)c(Br)c2OCC(=O)O |
| SMILES_CANONICAL | CACTVS | 3.341 | OC(=O)COc1c(Br)c(sc1C(O)=O)c2ccccc2 |
| SMILES | CACTVS | 3.341 | OC(=O)COc1c(Br)c(sc1C(O)=O)c2ccccc2 |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.5.0 | c1ccc(cc1)c2c(c(c(s2)C(=O)O)OCC(=O)O)Br |
| SMILES | OpenEye OEToolkits | 1.5.0 | c1ccc(cc1)c2c(c(c(s2)C(=O)O)OCC(=O)O)Br |
| InChI | InChI | 1.03 | InChI=1S/C13H9BrO5S/c14-9-10(19-6-8(15)16)12(13(17)18)20-11(9)7-4-2-1-3-5-7/h1-5H,6H2,(H,15,16)(H,17,18) |
| InChIKey | InChI | 1.03 | MVDWLRCTJUXCCB-UHFFFAOYSA-N |
