Citric Acid → N-[3,5-Bis(trifluoromethyl)phenyl]-2-hydroxy-5-[(trimethylsilyl)ethynyl]benzamide
Reaction equation
[CH3:26][Si:27]([CH3:28])([CH3:29])[C:30]#[CH:31].[CH3:46][CH2:47][N:48]([CH2:49][CH3:50])[CH2:51][CH3:52].[CH3:53][N:54]([CH3:55])[CH:56]=[O:57].[CH3:58][CH2:59][CH2:60][CH2:61][CH2:62][CH3:63].[CH3:64][CH2:65][O:66][C:67](=[O:68])[CH3:69].[F:1][C:2]([c:3]1[cH:4][c:5]([NH:13][C:14]([c:15]2[c:16]([OH:22])[cH:17][cH:18][c:19]([I:21])[cH:20]2)=[O:23])[cH:6][c:7]([C:9]([F:10])([F:11])[F:12])[cH:8]1)([F:24])[F:25].[I-:32].[OH:33][C:34]([CH2:35][C:36]([C:37](=[O:38])[OH:39])([CH2:40][C:41](=[O:42])[OH:43])[OH:44])=[O:45]>>[F:1][C:2]([c:3]1[cH:4][c:5]([NH:13][C:14]([c:15]2[c:16]([OH:22])[cH:17][cH:18][c:19]([C:31]#[C:30][Si:27]([CH3:26])([CH3:28])[CH3:29])[cH:20]2)=[O:23])[cH:6][c:7]([C:9]([F:10])([F:11])[F:12])[cH:8]1)([F:24])[F:25]Participants
9
Reactant 8
Product 1
Sources & evidence
- ORD record
- ord-655ccfb206b049039e2aef4255ac774c
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (8/10)
Reaction notes
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