Type | Program | Version | Descriptor |
SMILES | ACDLabs | 10.04 | O=S(=O)(O)c1ccc2c(c1)ccc(c2)S(=O)(=O)O |
SMILES_CANONICAL | CACTVS | 3.341 | O[S](=O)(=O)c1ccc2cc(ccc2c1)[S](O)(=O)=O |
SMILES | CACTVS | 3.341 | O[S](=O)(=O)c1ccc2cc(ccc2c1)[S](O)(=O)=O |
SMILES_CANONICAL | OpenEye OEToolkits | 1.5.0 | c1cc(cc2c1cc(cc2)S(=O)(=O)O)S(=O)(=O)O |
SMILES | OpenEye OEToolkits | 1.5.0 | c1cc(cc2c1cc(cc2)S(=O)(=O)O)S(=O)(=O)O |
InChI | InChI | 1.03 | InChI=1S/C10H8O6S2/c11-17(12,13)9-3-1-7-5-10(18(14,15)16)4-2-8(7)6-9/h1-6H,(H,11,12,13)(H,14,15,16) |
InChIKey | InChI | 1.03 | FITZJYAVATZPMJ-UHFFFAOYSA-N |