Catalytic aza-Nazarov cyclization reactions to access α-methylene-γ-lactam heterocycles

Bilge Banu Yagci, Selin Ezgi Donmez, Onur Şahin and Yunus Emre Türkmen
Beilstein J. Org. Chem. 2023, 19, 66–77. https://doi.org/10.3762/bjoc.19.6

Chemical Information

Calculated using the Chemistry Development Kit 2.12
Molecular Formula C19H27NO2
Molecular Weight 301.42 g/mol
Exact Mass 301.2042 Da
InChI
InChI=1S/C19H27NO2/c1-6-11-20-18(15-7-9-16(22-5)10-8-15)17(12-13(2)3)14(4)19(20)21/h7-10,13,17-18H,4,6,11-12H2,1-3,5H3/t17-,18+/m0/s1
InChIKey
CKKQVWOCSZLAMB-ZWKOTPCHSA-N
SMILES
CCCN1[C@H](C2=CC=C(C=C2)OC)[C@@H](CC(C)C)C(=C)C1=O
Number of Atoms 49
Number of H-Bond Acceptors 3
Number of H-Bond Donors 0
Atoms in the Largest π-System 7
XLogP 3.5
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