Base information
| Cat. No. | |
| CAS No. | 61221-41-8 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C18H15NO5 |
| Molecular Weight | 325.315 |
| Exact Mass | 325.095 |
| XLogP3 | 1.0271 |
| Mr | 87.5405 |
| PSA | 82.7 |
| Sequence | - |
| Atom number | 39 |
| Bond number | 42 |
| Ring number | 5 |
| Rotor number | 0 |
| Residues number | 0 |
| Canonical smiles | Oc1cc2CC[n+]3c2c(c1)c1cc2OCOc2cc1c3.[O-]C(=O)C |
