Acetic Acid → HCID 21923079, compound
Reaction equation
[C:35]([BH3-:36])#[N:37].[CH3:20][OH:21].[CH3:39][C:40](=[O:41])[OH:42].[F:22][C:23]([O:24][c:25]1[cH:26][cH:27][c:28]([CH:29]=[O:30])[cH:31][cH:32]1)([F:33])[F:34].[NH2:1][CH2:2][CH2:3][NH:4][c:5]1[c:6]2[n:7][cH:8][n:9]([CH:15]3[CH2:16][CH2:17][CH2:18][CH2:19]3)[c:10]2[n:11][c:12]([Cl:14])[n:13]1.[Na+:38]>>[NH:1]([CH2:2][CH2:3][NH:4][c:5]1[c:6]2[n:7][cH:8][n:9]([CH:15]3[CH2:16][CH2:17][CH2:18][CH2:19]3)[c:10]2[n:11][c:12]([Cl:14])[n:13]1)[CH2:29][c:28]1[cH:27][cH:26][c:25]([O:24][C:23]([F:22])([F:33])[F:34])[cH:32][cH:31]1Participants
7
Sources & evidence
- ORD record
- ord-f235ba5ac8c64742bedba1d1097faa7c
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (4/10)
Reaction notes
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