3,5-Dimethylisoxazole → HCID 5271192, compound
Reaction equation
[C:8]([CH3:9])([CH3:10])([CH3:11])[O:12][C:13](=[O:14])[c:15]1[cH:16][cH:17][c:18]([O:19][CH2:20][CH2:21][CH2:22][CH2:23][CH2:24][CH2:25][Br:26])[cH:27][cH:28]1.[CH3:1][c:2]1[n:3][o:4][c:5]([CH3:7])[cH:6]1>>[CH3:1][c:2]1[n:3][o:4][c:5]([CH2:7][CH2:25][CH2:24][CH2:23][CH2:22][CH2:21][CH2:20][O:19][c:18]2[cH:17][cH:16][c:15]([C:13]([O:12][C:8]([CH3:9])([CH3:10])[CH3:11])=[O:14])[cH:28][cH:27]2)[cH:6]1Participants
3
Sources & evidence
- ORD record
- ord-370cf28bab684ecc9b63e34df75e4528
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (3/10)
Reaction notes
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