Acetic Acid → HCID 470669, compound
Reaction equation
[C:23]([BH3-:24])#[N:25].[CH3:34][C:35](=[O:36])[OH:37].[CH3:38][OH:39].[Cl:1][c:2]1[cH:3][cH:4][c:5]2[c:11]([n:12]1)[N:10]([CH2:13][CH3:14])[c:9]1[c:8]([cH:18][c:17]([CH:19]=[O:20])[cH:16][n:15]1)[C:7](=[O:21])[N:6]2[CH3:22].[NH2:27][c:28]1[cH:29][cH:30][cH:31][cH:32][cH:33]1.[Na+:26]>>[Cl:1][c:2]1[cH:3][cH:4][c:5]2[c:11]([n:12]1)[N:10]([CH2:13][CH3:14])[c:9]1[c:8]([cH:18][c:17]([CH2:19][NH:27][c:28]3[cH:29][cH:30][cH:31][cH:32][cH:33]3)[cH:16][n:15]1)[C:7](=[O:21])[N:6]2[CH3:22]Participants
7
Sources & evidence
- ORD record
- ord-91d6dc0e4abb4b0d8eaa2eadfdb06cfc
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (2/10)
Reaction notes
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