Methanol → HCID 54377894, compound
Reaction equation
[CH2:1]([c:2]1[n:3](-[c:4]2[c:5]([F:6])[cH:7][cH:8][cH:9][c:10]2[Cl:11])[c:12]([CH:13]=[O:14])[c:15]([CH3:16])[n:17]1)[CH2:18][CH2:19][CH3:20].[CH2:29]([CH2:30][CH2:31][CH3:32])[c:33]1[n:34]([CH2:51][c:52]2[c:53]([Cl:59])[cH:54][cH:55][cH:56][c:57]2[F:58])[c:35]([CH:38]=[C:39]([C:40](=[O:41])[O:42][CH3:43])[CH2:44][c:45]2[cH:46][cH:47][cH:48][cH:49][cH:50]2)[cH:36][n:37]1.[CH3:23][O:24][CH2:25][CH2:26][O:27][CH3:28].[CH3:60][CH2:61][O:62][C:63](=[O:64])[CH3:65].[CH3:66][OH:67].[CH3:68][CH2:69][CH2:70][CH2:71][CH2:72][CH3:73].[H-:21].[Na+:22]>>[CH2:29]([CH2:30][CH2:31][CH3:32])[c:33]1[n:34]([CH2:51][c:52]2[c:53]([Cl:59])[cH:54][cH:55][cH:56][c:57]2[F:58])[c:35]([CH:38]=[C:39]([C:40](=[O:41])[OH:42])[CH2:44][c:45]2[cH:46][cH:47][cH:48][cH:49][cH:50]2)[cH:36][n:37]1Participants
9
Sources & evidence
- ORD record
- ord-c41964cc9c1940c2a5a2503d4abfb90f
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (8/10)
Reaction notes
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