Base information
| Cat. No. | |
| CAS No. | 3486-67-7 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C21H22NO4+ |
| Molecular Weight | 352.404 |
| Exact Mass | 352.155 |
| XLogP3 | 3.3848 |
| Mr | 101.795 |
| PSA | 40.8 |
| Sequence | - |
| Atom number | 48 |
| Bond number | 51 |
| Ring number | 4 |
| Rotor number | 4 |
| Residues number | 0 |
| Canonical smiles | COc1cc2CC[n+]3c(-c2cc1OC)cc1c(c3)c(OC)c(cc1)OC |
