Type | Program | Version | Descriptor |
SMILES | ACDLabs | 12.01 | O=S(=O)(N(CC(=O)NO)CCO)c1ccc(OC)cc1 |
SMILES_CANONICAL | CACTVS | 3.370 | COc1ccc(cc1)[S](=O)(=O)N(CCO)CC(=O)NO |
SMILES | CACTVS | 3.370 | COc1ccc(cc1)[S](=O)(=O)N(CCO)CC(=O)NO |
SMILES_CANONICAL | OpenEye OEToolkits | 1.7.0 | COc1ccc(cc1)S(=O)(=O)N(CCO)CC(=O)NO |
SMILES | OpenEye OEToolkits | 1.7.0 | COc1ccc(cc1)S(=O)(=O)N(CCO)CC(=O)NO |
InChI | InChI | 1.03 | InChI=1S/C11H16N2O6S/c1-19-9-2-4-10(5-3-9)20(17,18)13(6-7-14)8-11(15)12-16/h2-5,14,16H,6-8H2,1H3,(H,12,15) |
InChIKey | InChI | 1.03 | IVGHGMHNUBCTDC-UHFFFAOYSA-N |