Base information
| Cat. No. | |
| CAS No. | 15518-68-0 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C17H18N3O3+ |
| Molecular Weight | 312.343 |
| Exact Mass | 312.135 |
| XLogP3 | 4.29388 |
| Mr | 87.9982 |
| PSA | 75.71 |
| Sequence | - |
| Atom number | 41 |
| Bond number | 42 |
| Ring number | 2 |
| Rotor number | 7 |
| Residues number | 0 |
| Canonical smiles | CCOc1cc([N+]#N)c(cc1NC(=O)c1ccccc1)OCC |
