Trifluoroacetic acid → HCID 21035371, compound
Reaction equation
[CH3:36][CH2:37][N:38]([CH2:39][CH3:40])[CH2:41][CH3:42].[CH3:43][O:44][C:45](=[O:46])[Cl:47].[CH3:48][C:49]([N:50]([CH3:51])[CH3:52])=[O:53].[F:1][C:2]([F:3])([F:4])[C:5]([OH:6])=[O:7].[NH2:8][CH2:9][c:10]1[c:11]([CH2:12][O:13][c:14]2[c:15]([Br:30])[c:16](=[O:29])[n:17](-[c:21]3[c:22]([F:28])[cH:23][cH:24][cH:25][c:26]3[F:27])[c:18]([CH3:20])[cH:19]2)[cH:31][cH:32][c:33]([F:35])[cH:34]1>>[NH:8]([CH2:9][c:10]1[c:11]([CH2:12][O:13][c:14]2[c:15]([Br:30])[c:16](=[O:29])[n:17](-[c:21]3[c:22]([F:28])[cH:23][cH:24][cH:25][c:26]3[F:27])[c:18]([CH3:20])[cH:19]2)[cH:31][cH:32][c:33]([F:35])[cH:34]1)[C:45]([O:44][CH3:43])=[O:46]Participants
6
Sources & evidence
- ORD record
- ord-b202dca02adb4fa8af4bd75aa9a9acd9
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (8/10)
Reaction notes
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