Ethanol → 2-ethoxy-3-(4-{2-[2-(pentafluoroethyl)-1H-benzimidazol-1-yl]ethoxy}phenyl)propanoic acid
Reaction equation
[CH2:1]([CH3:2])[O:3][CH:4]([C:5](=[O:6])[O:7][CH2:8][CH3:9])[CH2:10][c:11]1[cH:12][cH:13][c:14]([O:17][CH2:18][CH2:19][n:20]2[c:21]([C:29]([C:30]([F:31])([F:32])[F:33])([F:34])[F:35])[n:22][c:23]3[c:24]2[cH:25][cH:26][cH:27][cH:28]3)[cH:15][cH:16]1.[CH3:38][CH2:39][OH:40].[Na+:37].[OH-:36].[OH2:41]>>[CH2:1]([CH3:2])[O:3][CH:4]([C:5](=[O:6])[OH:7])[CH2:10][c:11]1[cH:12][cH:13][c:14]([O:17][CH2:18][CH2:19][n:20]2[c:21]([C:29]([C:30]([F:31])([F:32])[F:33])([F:34])[F:35])[n:22][c:23]3[c:24]2[cH:25][cH:26][cH:27][cH:28]3)[cH:15][cH:16]1Participants
6
Sources & evidence
- ORD record
- ord-41f8630b663e44fa83a1e6a141fda08e
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (7/10)
Reaction notes
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