Acetic Acid → HCID 13850685, compound
Reaction equation
[CH3:32][CH2:33][OH:34].[CH3:36][C:37](=[O:38])[OH:39].[Cl:1][c:2]1[c:3]([F:29])[cH:4][c:5]2[c:6](=[O:28])[c:7]([C:23](=[O:24])[O:25][CH2:26][CH3:27])[c:8]3[n:9]([c:10]2[cH:11]1)[c:12]([CH2:15][N:16]1[CH2:17][CH2:18][N:19]([CH3:22])[CH2:20][CH2:21]1)[cH:13][s:14]3.[K+:31].[OH-:30].[OH2:35]>>[Cl:1][c:2]1[c:3]([F:29])[cH:4][c:5]2[c:6](=[O:28])[c:7]([C:23](=[O:24])[OH:25])[c:8]3[n:9]([c:10]2[cH:11]1)[c:12]([CH2:15][N:16]1[CH2:17][CH2:18][N:19]([CH3:22])[CH2:20][CH2:21]1)[cH:13][s:14]3Participants
7
Sources & evidence
- ORD record
- ord-8155f17ad851499d985a18db39abf44b
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (1/10)
Reaction notes
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