Base information
| Cat. No. | |
| CAS No. | 162854-37-7 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C17H14NO4+ |
| Molecular Weight | 296.297 |
| Exact Mass | 296.092 |
| XLogP3 | 2.1728 |
| Mr | 83.919 |
| PSA | 84.8 |
| Sequence | - |
| Atom number | 36 |
| Bond number | 39 |
| Ring number | 4 |
| Rotor number | 0 |
| Residues number | 0 |
| Canonical smiles | Oc1cc2CC[n+]3c(-c2cc1O)cc1c(c3)c(O)c(cc1)O |