| Type | Program | Version | Descriptor |
| SMILES_CANONICAL | CACTVS | 3.352 | CCN(CC)[S](=O)(=O)c1cc(ccc1Br)C(=O)Nc2ccccc2C(O)=O |
| SMILES | CACTVS | 3.352 | CCN(CC)[S](=O)(=O)c1cc(ccc1Br)C(=O)Nc2ccccc2C(O)=O |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.7.0 | CCN(CC)S(=O)(=O)c1cc(ccc1Br)C(=O)Nc2ccccc2C(=O)O |
| SMILES | OpenEye OEToolkits | 1.7.0 | CCN(CC)S(=O)(=O)c1cc(ccc1Br)C(=O)Nc2ccccc2C(=O)O |
| InChI | InChI | 1.03 | InChI=1S/C18H19BrN2O5S/c1-3-21(4-2)27(25,26)16-11-12(9-10-14(16)19)17(22)20-15-8-6-5-7-13(15)18(23)24/h5-11H,3-4H2,1-2H3,(H,20,22)(H,23,24) |
| InChIKey | InChI | 1.03 | VNOMZKMKBNFCMC-UHFFFAOYSA-N |
