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 | C36H30Br2N2O4 |
| Molecular Weight | 714.44 g/mol |
| Exact Mass | 712.0573 Da |
| InChI |
InChI=1S/C36H30Br2N2O4/c1-3-39-28-17-15-24(37)19-26(28)34(32(39)42)21-35(44,23-13-9-6-10-14-23)36(31(34)30(41)22-11-7-5-8-12-22)27-20-25(38)16-18-29(27)40(4-2)33(36)43/h5-20,31,44H,3-4,21H2,1-2H3/t31-,34-,35+,36+/m0/s1
|
| InChIKey |
ICLDEYWTWHEIAC-QTHRWXHQSA-N
|
| SMILES |
CCN1C2=CC=C(C=C2[C@]3(C[C@@](C4=CC=CC=C4)([C@]5(C6=CC(=CC=C6N(CC)C5=O)Br)[C@H]3C(=O)C7=CC=CC=C7)O)C1=O)Br
|
| Number of Atoms | 74 |
| Number of H-Bond Acceptors | 6 |
| Number of H-Bond Donors | 1 |
| Atoms in the Largest π-System | 9 |
| XLogP | 3.4 |
