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 | C17H13NO6 |
| Molecular Weight | 327.29 g/mol |
| Exact Mass | 327.0743 Da |
| InChI |
InChI=1S/C17H13NO6/c1-22-14(19)8-12-10(17(21)23-2)7-11-15(20)9-5-3-4-6-13(9)24-16(11)18-12/h3-7H,8H2,1-2H3
|
| InChIKey |
FPUQUXOBPMEMJJ-UHFFFAOYSA-N
|
| SMILES |
COC(=O)CC1=C(C=C2C(=O)C3=C(C=CC=C3)OC2=N1)C(=O)OC
|
| Number of Atoms | 37 |
| Number of H-Bond Acceptors | 7 |
| Number of H-Bond Donors | 0 |
| Atoms in the Largest π-System | 18 |
| XLogP | 0.2 |