Type | Program | Version | Descriptor |
SMILES | ACDLabs | 12.01 | O=S(=O)(N)c2ccc(c1ccc(c(F)c1)C(F)(F)F)cc2 |
InChI | InChI | 1.03 | InChI=1S/C13H9F4NO2S/c14-12-7-9(3-6-11(12)13(15,16)17)8-1-4-10(5-2-8)21(18,19)20/h1-7H,(H2,18,19,20) |
InChIKey | InChI | 1.03 | UEPKMFLFRNDVAW-UHFFFAOYSA-N |
SMILES_CANONICAL | CACTVS | 3.385 | N[S](=O)(=O)c1ccc(cc1)c2ccc(c(F)c2)C(F)(F)F |
SMILES | CACTVS | 3.385 | N[S](=O)(=O)c1ccc(cc1)c2ccc(c(F)c2)C(F)(F)F |
SMILES_CANONICAL | OpenEye OEToolkits | 1.7.6 | c1cc(ccc1c2ccc(c(c2)F)C(F)(F)F)S(=O)(=O)N |
SMILES | OpenEye OEToolkits | 1.7.6 | c1cc(ccc1c2ccc(c(c2)F)C(F)(F)F)S(=O)(=O)N |