Domino reactions of chromones with activated carbonyl compounds
Peter Langer
Beilstein J. Org. Chem. 2024, 20, 1256–1269.
https://doi.org/10.3762/bjoc.20.108
Chemical Information
Calculated using the Chemistry Development Kit 2.12
| Molecular Formula | C17H15NO7 |
| Molecular Weight | 345.30 g/mol |
| Exact Mass | 345.0848 Da |
| InChI |
InChI=1S/C17H15NO7/c1-24-15(21)8-14(20)12(17(23)25-2)7-10(9-18)16(22)11-5-3-4-6-13(11)19/h3-7,12,19H,8H2,1-2H3/b10-7+
|
| InChIKey |
IXBPXFQKPDQQBJ-JXMROGBWSA-N
|
| SMILES |
COC(=O)CC(=O)C(/C=C(\C#N)/C(=O)C1=C(C=CC=C1)O)C(=O)OC
|
| Number of Atoms | 40 |
| Number of H-Bond Acceptors | 8 |
| Number of H-Bond Donors | 1 |
| Atoms in the Largest π-System | 13 |
| XLogP | 1.2 |
