3,3-Dimethylbutanoyl chloride → N-{4-[(4-butylphenyl)ethynyl]benzyl}-N-(2,2-dimethyl-4-oxo-4H-1,3-benzodioxin-7-yl)-3,3-dimethylbutanamide
Reaction equation
[C:34]([CH3:35])([CH3:36])([CH3:37])[CH2:38][C:39](=[O:40])[Cl:41].[CH2:1]([CH2:2][CH2:3][CH3:4])[c:5]1[cH:6][cH:7][c:8]([C:11]#[C:12][c:13]2[cH:14][cH:15][c:16]([CH2:17][NH:18][c:19]3[cH:20][cH:21][c:22]4[c:23]([cH:31]3)[O:24][C:25]([CH3:29])([CH3:30])[O:26][C:27]4=[O:28])[cH:32][cH:33]2)[cH:9][cH:10]1>>[CH2:1]([CH2:2][CH2:3][CH3:4])[c:5]1[cH:6][cH:7][c:8]([C:11]#[C:12][c:13]2[cH:14][cH:15][c:16]([CH2:17][N:18]([c:19]3[cH:20][cH:21][c:22]4[c:23]([cH:31]3)[O:24][C:25]([CH3:29])([CH3:30])[O:26][C:27]4=[O:28])[C:39]([CH2:38][C:34]([CH3:35])([CH3:36])[CH3:37])=[O:40])[cH:32][cH:33]2)[cH:9][cH:10]1Participants
3
Sources & evidence
- ORD record
- ord-b30eae85ddd548ae8c4d49603666d629
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (10/10)
Reaction notes
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