Type | Program | Version | Descriptor |
SMILES | ACDLabs | 10.04 | Fc1ccc(cc1C)S(=O)(=O)NC(C(=O)NO)C2CCOCC2 |
SMILES_CANONICAL | CACTVS | 3.341 | Cc1cc(ccc1F)[S](=O)(=O)N[C@H](C2CCOCC2)C(=O)NO |
SMILES | CACTVS | 3.341 | Cc1cc(ccc1F)[S](=O)(=O)N[CH](C2CCOCC2)C(=O)NO |
SMILES_CANONICAL | OpenEye OEToolkits | 1.5.0 | Cc1cc(ccc1F)S(=O)(=O)N[C@H](C2CCOCC2)C(=O)NO |
SMILES | OpenEye OEToolkits | 1.5.0 | Cc1cc(ccc1F)S(=O)(=O)NC(C2CCOCC2)C(=O)NO |
InChI | InChI | 1.03 | InChI=1S/C14H19FN2O5S/c1-9-8-11(2-3-12(9)15)23(20,21)17-13(14(18)16-19)10-4-6-22-7-5-10/h2-3,8,10,13,17,19H,4-7H2,1H3,(H,16,18)/t13-/m1/s1 |
InChIKey | InChI | 1.03 | LUCFRFDOOYLALP-CYBMUJFWSA-N |