Type | Program | Version | Descriptor |
SMILES | ACDLabs | 11.02 | O=C(O)Cn1c4ccc(OC)cc4cc1CNS(=O)(=O)c3oc2ccccc2c3 |
SMILES_CANONICAL | CACTVS | 3.352 | COc1ccc2n(CC(O)=O)c(CN[S](=O)(=O)c3oc4ccccc4c3)cc2c1 |
SMILES | CACTVS | 3.352 | COc1ccc2n(CC(O)=O)c(CN[S](=O)(=O)c3oc4ccccc4c3)cc2c1 |
SMILES_CANONICAL | OpenEye OEToolkits | 1.7.0 | COc1ccc2c(c1)cc(n2CC(=O)O)CNS(=O)(=O)c3cc4ccccc4o3 |
SMILES | OpenEye OEToolkits | 1.7.0 | COc1ccc2c(c1)cc(n2CC(=O)O)CNS(=O)(=O)c3cc4ccccc4o3 |
InChI | InChI | 1.03 | InChI=1S/C20H18N2O6S/c1-27-16-6-7-17-14(9-16)8-15(22(17)12-19(23)24)11-21-29(25,26)20-10-13-4-2-3-5-18(13)28-20/h2-10,21H,11-12H2,1H3,(H,23,24) |
InChIKey | InChI | 1.03 | WZHKFPDZEVEAJG-UHFFFAOYSA-N |