Hydrochloric Acid → 2-Cyano-2-(2-nitro-5-phenoxy-benzyl)-hex-5-enoic acid
Reaction equation
[CH2:1]([CH3:2])[O:3][C:4]([C:5]([CH2:6][CH2:7][CH:8]=[CH2:9])([CH2:10][c:11]1[c:12]([N+:24](=[O:25])[O-:26])[cH:13][cH:14][c:15]([O:17][c:18]2[cH:19][cH:20][cH:21][cH:22][cH:23]2)[cH:16]1)[C:27]#[N:28])=[O:29].[CH3:33][OH:34].[ClH:32].[Li+:31].[OH-:30].[OH2:35]>>[O:3]=[C:4]([C:5]([CH2:6][CH2:7][CH:8]=[CH2:9])([CH2:10][c:11]1[c:12]([N+:24](=[O:25])[O-:26])[cH:13][cH:14][c:15]([O:17][c:18]2[cH:19][cH:20][cH:21][cH:22][cH:23]2)[cH:16]1)[C:27]#[N:28])[OH:29]Participants
7
Sources & evidence
- ORD record
- ord-94ac46d2b55241b7ba5dd561912ca35b
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (2/10)
Reaction notes
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