Methanol → HCID 58838571, compound

HRID 137076Notes

Reaction equation

HRID 137076 reaction equation
[CH3:30][C:31]([Cl:32])=[O:33].[CH3:34][C:35]([O:36][C:37](=[O:38])[CH3:39])=[O:40].[CH3:46][CH2:47][N:48]([CH2:49][CH3:50])[CH2:51][CH3:52].[CH3:53][OH:54].[F:3][c:4]1[c:5]([C:14](=[O:15])[NH:16][c:17]2[c:18]([CH:23]([CH2:24][C:25]([CH3:26])([CH3:27])[CH3:28])[CH3:29])[cH:19][cH:20][cH:21][cH:22]2)[c:6]([C:10]([F:11])([F:12])[F:13])[n:7][n:8]1[CH3:9].[H-:1].[Na+:2].[O:41]1[CH2:42][CH2:43][CH2:44][CH2:45]1>>[F:3][c:4]1[c:5]([C:14](=[O:15])[N:16]([c:17]2[c:18]([CH:23]([CH2:24][C:25]([CH3:26])([CH3:27])[CH3:28])[CH3:29])[cH:19][cH:20][cH:21][cH:22]2)[C:31]([CH3:30])=[O:33])[c:6]([C:10]([F:11])([F:12])[F:13])[n:7][n:8]1[CH3:9]

Participants

9

Sources & evidence

ORD record
ord-57042e04f4a74a81bcdccc6f31b4b3c0
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (9/10)

Reaction notes

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