Base information
| Cat. No. | |
| CAS No. | 89823-23-4 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C22H23NO3 |
| Molecular Weight | 349.423 |
| Exact Mass | 349.168 |
| XLogP3 | 4.89368 |
| Mr | 102.352 |
| PSA | 59.32 |
| Sequence | - |
| Atom number | 49 |
| Bond number | 50 |
| Ring number | 2 |
| Rotor number | 11 |
| Residues number | 0 |
| Canonical smiles | C=CC(=O)OCCCCCCOc1ccc(cc1)c1ccc(cc1)C#N |
