Base information
| Cat. No. | |
| CAS No. | 2098487-52-4 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C20H20N2O7 |
| Molecular Weight | 400.382 |
| Exact Mass | 400.127 |
| XLogP3 | 0.3997 |
| Mr | 106.618 |
| PSA | 111.24 |
| Sequence | - |
| Atom number | 49 |
| Bond number | 51 |
| Ring number | 3 |
| Rotor number | 9 |
| Residues number | 0 |
| Canonical smiles | C(Oc1cccc2c1C(=O)N(C2=O)C1CCC(=O)NC1=O)COCCOCC#C |
