Base information
| Cat. No. | |
| CAS No. | 49679-20-1 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C19H14NO5+ |
| Molecular Weight | 336.318 |
| Exact Mass | 336.087 |
| XLogP3 | 2.3186 |
| Mr | 90.9855 |
| PSA | 68.87 |
| Sequence | - |
| Atom number | 39 |
| Bond number | 43 |
| Ring number | 5 |
| Rotor number | 1 |
| Residues number | 0 |
| Canonical smiles | COc1cc2cc[n+](c3c2c(-c2cc4OCOc4cc2C3=O)c1O)C |
