Base information
| Cat. No. | |
| CAS No. | 34959-30-3 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C22H24ClNO5 |
| Molecular Weight | 417.883 |
| Exact Mass | 417.134 |
| XLogP3 | 1.0467 |
| Mr | 118.632 |
| PSA | 61.81 |
| Sequence | - |
| Atom number | 53 |
| Bond number | 56 |
| Ring number | 5 |
| Rotor number | 2 |
| Residues number | 0 |
| Canonical smiles | COc1c2c(=O)c3C[N+]4(CCCCC4)CC(=C)c3oc2c(c2c1cco2)OC.[Cl-] |
