Benzene → HCID 86635117, compound
Reaction equation
[CH2:41]([P:42]([CH2:43][CH2:44][CH2:45][CH3:46])[CH2:47][CH2:48][CH2:49][CH3:50])[CH2:51][CH2:52][CH3:53].[F:54][C:55]([C:56]([C:57]([F:58])([F:59])[F:60])([OH:61])[CH3:62])([F:63])[F:64].[N:23]([C:24]([N:25]1[CH2:26][CH2:27][CH2:28][CH2:29][CH2:30]1)=[O:31])=[N:32][C:33]([N:34]1[CH2:35][CH2:36][CH2:37][CH2:38][CH2:39]1)=[O:40].[OH:1][CH2:2][CH2:3][CH2:4][c:5]1[cH:6][cH:7][c:8](-[c:11]2[o:12][c:13]3[c:14]([n:15]2)[cH:16][c:17]([C:21]#[N:22])[cH:18][c:19]3[CH3:20])[cH:9][cH:10]1.[cH:65]1[cH:66][cH:67][cH:68][cH:69][cH:70]1>>[O:1]([CH2:2][CH2:3][CH2:4][c:5]1[cH:6][cH:7][c:8](-[c:11]2[o:12][c:13]3[c:14]([n:15]2)[cH:16][c:17]([C:21]#[N:22])[cH:18][c:19]3[CH3:20])[cH:9][cH:10]1)[C:56]([C:55]([F:54])([F:63])[F:64])([C:57]([F:58])([F:59])[F:60])[CH3:62]Participants
6
Sources & evidence
- ORD record
- ord-faf80214ac9746689a590d29f56a379b
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (1/10)
Reaction notes
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