Hydrochloric Acid → (3-Hydroxy-5-oxo-5,6,7,8-tetrahydro-naphthalen-1-yloxy)-acetic acid tert-butyl ester
Reaction equation
[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6]([CH2:7][O:8][c:9]1[cH:10][c:11]([O:20][S:21]([C:22]([F:23])([F:24])[F:25])(=[O:26])=[O:27])[cH:12][c:13]2[c:18]1[CH2:17][CH2:16][CH2:15][C:14]2=[O:19])=[O:28].[CH3:30][CH2:31][CH2:32][CH2:33][N+:34]([CH2:35][CH2:36][CH2:37][CH3:38])([CH2:39][CH2:40][CH2:41][CH3:42])[CH2:43][CH2:44][CH2:45][CH3:46].[ClH:53].[F-:29].[O:47]1[CH2:48][CH2:49][CH2:50][CH2:51]1.[OH2:52]>>[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6]([CH2:7][O:8][c:9]1[cH:10][c:11]([OH:20])[cH:12][c:13]2[c:18]1[CH2:17][CH2:16][CH2:15][C:14]2=[O:19])=[O:28]Participants
7
Sources & evidence
- ORD record
- ord-68d08867a1fe48b783829a61de4531c3
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (1/10)
Reaction notes
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