Ethanol → HCID 59596396, compound
Reaction equation
[CH3:32][CH2:33][OH:34].[CH3:35][CH2:36][O:37][C:38]([CH3:39])=[O:40].[F:1][C:2]([c:3]1[cH:4][c:5]([NH:9][C:10](=[O:11])[N:12]2[CH2:13][CH2:14][c:15]3[cH:16][c:17]([O:21][c:22]4[n:23][c:24]([NH2:29])[n:25][c:26]([Cl:28])[cH:27]4)[cH:18][cH:19][c:20]32)[cH:6][cH:7][cH:8]1)([F:30])[F:31]>>[F:1][C:2]([c:3]1[cH:4][c:5]([NH:9][C:10](=[O:11])[N:12]2[CH2:13][CH2:14][c:15]3[cH:16][c:17]([O:21][c:22]4[n:23][c:24]([NH2:29])[n:25][cH:26][cH:27]4)[cH:18][cH:19][c:20]32)[cH:6][cH:7][cH:8]1)([F:30])[F:31]Participants
4
Sources & evidence
- ORD record
- ord-2cc786d2de1f4e76927841f0fbcd0398
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (3/10)
Reaction notes
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