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 | C46H36N2O4 |
| Molecular Weight | 680.79 g/mol |
| Exact Mass | 680.2675 Da |
| InChI |
InChI=1S/C46H36N2O4/c49-40(34-21-9-3-10-22-34)41-44(36-25-13-15-27-38(36)47(42(44)50)29-32-17-5-1-6-18-32)31-45(52,35-23-11-4-12-24-35)46(41)37-26-14-16-28-39(37)48(43(46)51)30-33-19-7-2-8-20-33/h1-28,41,52H,29-31H2/t41-,44-,45+,46+/m0/s1
|
| InChIKey |
WGWHEEYXXVHBIZ-FTHPJFHNSA-N
|
| SMILES |
C1=CC=C(C=C1)CN2C3=C(C=CC=C3)[C@]4(C[C@@](C5=CC=CC=C5)([C@]6(C7=C(C=CC=C7)N(CC8=CC=CC=C8)C6=O)[C@H]4C(=O)C9=CC=CC=C9)O)C2=O
|
| Number of Atoms | 88 |
| Number of H-Bond Acceptors | 6 |
| Number of H-Bond Donors | 1 |
| Atoms in the Largest π-System | 9 |
| XLogP | 3.6 |
