Methanol → [2-(4-Chloro-phenyl)-2,4,5,6,7,8-hexahydro-cycloheptapyrazol-3-yl]-cyclohexyl-acetic acid
Reaction equation
[CH2:1]([CH3:2])[O:3][C:4]([CH:5]([CH:6]1[CH2:7][CH2:8][CH2:9][CH2:10][CH2:11]1)[c:12]1[n:13](-[c:22]2[cH:23][cH:24][c:25]([Cl:28])[cH:26][cH:27]2)[n:14][c:15]2[c:16]1[CH2:17][CH2:18][CH2:19][CH2:20][CH2:21]2)=[O:29].[CH3:32][OH:33].[Na+:31].[OH-:30]>>[O:3]=[C:4]([CH:5]([CH:6]1[CH2:7][CH2:8][CH2:9][CH2:10][CH2:11]1)[c:12]1[n:13](-[c:22]2[cH:23][cH:24][c:25]([Cl:28])[cH:26][cH:27]2)[n:14][c:15]2[c:16]1[CH2:17][CH2:18][CH2:19][CH2:20][CH2:21]2)[OH:29]Participants
5
Sources & evidence
- ORD record
- ord-2bd5379043a345dc8d269cb9171834da
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (10/10)
Reaction notes
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