Hydrochloric Acid → 4-Tert-butylcinnamic acid
Reaction equation
[C:1]([N:2]1[c:3]2[c:4]([cH:5][cH:6][c:7]([NH:8][C:14]([CH:15]=[CH:16][c:17]3[cH:18][cH:19][c:20]([C:23]([CH3:24])([CH3:25])[CH3:26])[cH:21][cH:22]3)=[O:27])[cH:9]2)[C:10]([CH3:11])([CH3:12])[CH2:13]1)(=[O:28])[CH3:29].[C:30]([N:31]1[c:33]2[c:34]([cH:35][cH:36][c:37]([N+:38]([O-:39])=[O:40])[cH:41]2)[C:42]([CH3:43])([CH3:44])[CH2:45]1)(=[O:32])[CH3:46].[CH2:53]([O:54][CH2:55][CH3:56])[CH3:57].[ClH:52].[OH2:47].[OH2:48].[Sn:49]([Cl:50])[Cl:51]>>[C:14]([CH:15]=[CH:16][c:17]1[cH:18][cH:19][c:20]([C:23]([CH3:24])([CH3:25])[CH3:26])[cH:21][cH:22]1)([OH:27])=[O:32]Participants
7
Sources & evidence
- ORD record
- ord-891249b7af14409a8a164e950516e414
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (5/10)
Reaction notes
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