Toluene → [5-Cyclobutyl-3-(2,6-dichlorophenyl)-4-isoxazolyl]methanol
Reaction equation
[CH2:24]([Al+:25][CH2:26][CH:27]([CH3:28])[CH3:29])[CH:30]([CH3:31])[CH3:32].[CH2:40]1[O:41][CH2:42][CH2:43][CH2:44]1.[CH3:33][c:34]1[cH:35][cH:36][cH:37][cH:38][cH:39]1.[CH:1]1([c:5]2[c:6]([C:18](=[O:19])[O:20][CH2:21][CH3:22])[c:7](-[c:10]3[c:11]([Cl:17])[cH:12][cH:13][cH:14][c:15]3[Cl:16])[n:8][o:9]2)[CH2:2][CH2:3][CH2:4]1.[H-:23]>>[CH:1]1([c:5]2[c:6]([CH2:18][OH:19])[c:7](-[c:10]3[c:11]([Cl:17])[cH:12][cH:13][cH:14][c:15]3[Cl:16])[n:8][o:9]2)[CH2:2][CH2:3][CH2:4]1Participants
6
Sources & evidence
- ORD record
- ord-cb497f92ea224b5a8588995498fee739
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (6/10)
Reaction notes
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