Base information
| Cat. No. | |
| CAS No. | 88594-08-5 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C21H24N4O12 |
| Molecular Weight | 524.435 |
| Exact Mass | 524.139 |
| XLogP3 | 4.0096 |
| Mr | 132.133 |
| PSA | 220.55 |
| Sequence | - |
| Atom number | 61 |
| Bond number | 62 |
| Ring number | 2 |
| Rotor number | 15 |
| Residues number | 0 |
| Canonical smiles | [O-][N+](=O)OCCCOC(=O)C1=C(C)NC(=C(C1c1cccc(c1)[N+](=O)[O-])C(=O)OCC(O[N+](=O)[O-])C)C |
