Ethanol → [4-(4,9-diethoxy-1-oxo-1,3-dihydro-2H-benzo[f]isoindol-2-yl)phenyl]acetic acid
Reaction equation
[C:33](=[O:34])([O-:35])[O-:36].[CH2:1]([CH3:2])[O:3][c:4]1[c:5]2[c:6]([c:7]([O:26][CH2:27][CH3:28])[c:8]3[c:12]1[CH2:11][N:10]([c:13]1[cH:14][cH:15][c:16]([CH2:19][C:20](=[O:21])[O:22][CH2:23][CH3:24])[cH:17][cH:18]1)[C:9]3=[O:25])[cH:29][cH:30][cH:31][cH:32]2.[CH3:39][CH2:40][OH:41].[K+:37].[K+:38].[OH2:42]>>[CH2:1]([CH3:2])[O:3][c:4]1[c:5]2[c:6]([c:7]([O:26][CH2:27][CH3:28])[c:8]3[c:12]1[CH2:11][N:10]([c:13]1[cH:14][cH:15][c:16]([CH2:19][C:20](=[O:21])[OH:22])[cH:17][cH:18]1)[C:9]3=[O:25])[cH:29][cH:30][cH:31][cH:32]2Participants
6
Sources & evidence
- ORD record
- ord-d94b4a31221046e19ea7012d5599b59c
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (8/10)
Reaction notes
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