Base information
| Cat. No. | |
| CAS No. | 2095036-40-9 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C20H20N2O8S |
| Molecular Weight | 448.446 |
| Exact Mass | 448.094 |
| XLogP3 | 3.9259 |
| Mr | 116.399 |
| PSA | 144.18 |
| Sequence | - |
| Atom number | 51 |
| Bond number | 53 |
| Ring number | 3 |
| Rotor number | 8 |
| Residues number | 0 |
| Canonical smiles | CCOc1cc(ccc1OC)[C@H](N1C(=O)c2c(C1=O)cccc2[N+](=O)[O-])CS(=O)(=O)C |
