| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | c1(ccc(cc1)S(=O)(=O)O)S(Nc2c(nccc2)OC)(=O)=O |
| InChI | InChI | 1.03 | InChI=1S/C12H12N2O6S2/c1-20-12-11(3-2-8-13-12)14-21(15,16)9-4-6-10(7-5-9)22(17,18)19/h2-8,14H,1H3,(H,17,18,19) |
| InChIKey | InChI | 1.03 | YXYLOWSJBFRQDN-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | COc1ncccc1N[S](=O)(=O)c2ccc(cc2)[S](O)(=O)=O |
| SMILES | CACTVS | 3.385 | COc1ncccc1N[S](=O)(=O)c2ccc(cc2)[S](O)(=O)=O |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | COc1c(cccn1)NS(=O)(=O)c2ccc(cc2)S(=O)(=O)O |
| SMILES | OpenEye OEToolkits | 2.0.7 | COc1c(cccn1)NS(=O)(=O)c2ccc(cc2)S(=O)(=O)O |
