Clauson–Kaas pyrrole synthesis using diverse catalysts: a transition from conventional to greener approach
Dileep Kumar Singh and Rajesh Kumar
Beilstein J. Org. Chem. 2023, 19, 928–955.
https://doi.org/10.3762/bjoc.19.71
Chemical Information
Calculated using the Chemistry Development Kit 2.12
| Molecular Formula | C26H22N2O3 |
| Molecular Weight | 410.47 g/mol |
| Exact Mass | 410.1631 Da |
| InChI |
InChI=1S/C26H22N2O3/c1-30-22-14-12-20(13-15-22)28-24(25(26(28)29)31-23-10-3-2-4-11-23)19-8-7-9-21(18-19)27-16-5-6-17-27/h2-18,24-25H,1H3
|
| InChIKey |
VCHIANKSQQHGDF-UHFFFAOYSA-N
|
| SMILES |
COC1=CC=C(C=C1)N2C(C3=CC=CC(=C3)N4C=CC=C4)C(C2=O)OC5=CC=CC=C5
|
| Number of Atoms | 53 |
| Number of H-Bond Acceptors | 5 |
| Number of H-Bond Donors | 0 |
| Atoms in the Largest π-System | 11 |
| XLogP | 3.0 |
