Ethanol → (6-(5-{3-Cyano-4-[(1-methylethyl)oxy]phenyl}-1,2,4-oxadiazol-3-yl)-2-{[(1,1-dimethylethyl)oxy]carbonyl}-5-methyl-1,2,3,4-tetrahydro-1-isoquinolinyl)acetic acid
Reaction equation
[CH2:1]([CH2:2][CH2:3][CH3:4])[O:5][C:6]([CH2:7][CH:8]1[N:9]([C:36](=[O:37])[O:38][C:39]([CH3:40])([CH3:41])[CH3:42])[CH2:10][CH2:11][c:12]2[c:13]([CH3:35])[c:14](-[c:18]3[n:19][o:20][c:21](-[c:23]4[cH:24][c:25]([C:33]#[N:34])[c:26]([O:29][CH:30]([CH3:31])[CH3:32])[cH:27][cH:28]4)[n:22]3)[cH:15][cH:16][c:17]21)=[O:43].[CH3:46][CH2:47][OH:48].[Na+:45].[OH-:44]>>[O:5]=[C:6]([CH2:7][CH:8]1[N:9]([C:36](=[O:37])[O:38][C:39]([CH3:40])([CH3:41])[CH3:42])[CH2:10][CH2:11][c:12]2[c:13]([CH3:35])[c:14](-[c:18]3[n:19][o:20][c:21](-[c:23]4[cH:24][c:25]([C:33]#[N:34])[c:26]([O:29][CH:30]([CH3:31])[CH3:32])[cH:27][cH:28]4)[n:22]3)[cH:15][cH:16][c:17]21)[OH:43]Participants
5
Reactant 4
Product 1
Sources & evidence
- ORD record
- ord-d3bc810e7e294bef84159e3f440b671d
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (8/10)
Reaction notes
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