Type | Program | Version | Descriptor |
SMILES | ACDLabs | 12.01 | O=S(=O)(N(OC(C)C)CC(=O)NO)c2ccc(c1ccccc1)cc2 |
InChI | InChI | 1.03 | InChI=1S/C17H20N2O5S/c1-13(2)24-19(12-17(20)18-21)25(22,23)16-10-8-15(9-11-16)14-6-4-3-5-7-14/h3-11,13,21H,12H2,1-2H3,(H,18,20) |
InChIKey | InChI | 1.03 | PHGLPDURIUEELR-UHFFFAOYSA-N |
SMILES_CANONICAL | CACTVS | 3.370 | CC(C)ON(CC(=O)NO)[S](=O)(=O)c1ccc(cc1)c2ccccc2 |
SMILES | CACTVS | 3.370 | CC(C)ON(CC(=O)NO)[S](=O)(=O)c1ccc(cc1)c2ccccc2 |
SMILES_CANONICAL | OpenEye OEToolkits | 1.7.6 | CC(C)ON(CC(=O)NO)S(=O)(=O)c1ccc(cc1)c2ccccc2 |
SMILES | OpenEye OEToolkits | 1.7.6 | CC(C)ON(CC(=O)NO)S(=O)(=O)c1ccc(cc1)c2ccccc2 |