Methanol → 4-{2-[2-(4-Chloro-phenyl)-2,4,5,6,7,8-hexahydro-cycloheptapyrazol-3-yl]-2-cyclohexyl-acetylamino}-3-fluoro-benzoic acid
Reaction equation
[CH2:41]1[O:42][CH2:43][CH2:44][CH2:45]1.[CH3:1][O:2][C:3]([c:4]1[cH:5][c:6]([F:37])[c:7]([NH:10][C:11]([CH:12]([CH:13]2[CH2:14][CH2:15][CH2:16][CH2:17][CH2:18]2)[c:19]2[n:20](-[c:29]3[cH:30][cH:31][c:32]([Cl:35])[cH:33][cH:34]3)[n:21][c:22]3[c:23]2[CH2:24][CH2:25][CH2:26][CH2:27][CH2:28]3)=[O:36])[cH:8][cH:9]1)=[O:38].[CH3:46][OH:47].[Li+:39].[OH-:40]>>[O:2]=[C:3]([c:4]1[cH:5][c:6]([F:37])[c:7]([NH:10][C:11]([CH:12]([CH:13]2[CH2:14][CH2:15][CH2:16][CH2:17][CH2:18]2)[c:19]2[n:20](-[c:29]3[cH:30][cH:31][c:32]([Cl:35])[cH:33][cH:34]3)[n:21][c:22]3[c:23]2[CH2:24][CH2:25][CH2:26][CH2:27][CH2:28]3)=[O:36])[cH:8][cH:9]1)[OH:38]Participants
6
Reactant 5
Product 1
Sources & evidence
- ORD record
- ord-382f8f39cc314127a822e1b5d25b9013
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (3/10)
Reaction notes
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