Tosylhydrazine-promoted self-conjugate reduction–Michael/aldol reaction of 3-phenacylideneoxindoles towards dispirocyclopentanebisoxindole derivatives
Sayan Pramanik and Chhanda Mukhopadhyay
Beilstein J. Org. Chem. 2022, 18, 469–478.
https://doi.org/10.3762/bjoc.18.49
Chemical Information
Calculated using the Chemistry Development Kit 2.12
| Molecular Formula | C22H12N6O2 |
| Molecular Weight | 392.37 g/mol |
| Exact Mass | 392.1022 Da |
| InChI |
InChI=1S/C22H12N6O2/c23-9-14-17(26)20(10-24,11-25)22(13-6-2-4-8-16(13)28-19(22)30)21(14)12-5-1-3-7-15(12)27-18(21)29/h1-8H,26H2,(H,27,29)(H,28,30)/t21-,22+/m1/s1
|
| InChIKey |
OCWDYKNSBYAMBW-YADHBBJMSA-N
|
| SMILES |
C1=CC2=C(C=C1)NC(=O)[C@]23C(=C(C(C#N)(C#N)[C@]43C5=C(C=CC=C5)NC4=O)N)C#N
|
| Number of Atoms | 42 |
| Number of H-Bond Acceptors | 8 |
| Number of H-Bond Donors | 3 |
| Atoms in the Largest π-System | 9 |
| XLogP | -1.5 |
