Base information
| Cat. No. | |
| CAS No. | 159417-94-4 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C13H19N3O4 |
| Molecular Weight | 281.308 |
| Exact Mass | 281.138 |
| XLogP3 | 3.7395 |
| Mr | 77.9901 |
| PSA | 110.17 |
| Sequence | - |
| Atom number | 39 |
| Bond number | 39 |
| Ring number | 1 |
| Rotor number | 7 |
| Residues number | 0 |
| Canonical smiles | O=C(OC(C)(C)C)NCCc1ccc(c(c1)[N+](=O)[O-])N |
