Ethanol → HCID 22093453, compound
Reaction equation
[CH2:1]([CH3:2])[O:3][C:4]([CH2:5][O:6][c:7]1[c:8]([C:20]([NH:21][CH2:22][c:23]2[c:24]([F:30])[cH:25][c:26]([Br:29])[cH:27][cH:28]2)=[O:31])[cH:9][c:10]([N:14]2[CH2:15][CH2:16][O:17][CH2:18][CH2:19]2)[c:11]([F:13])[cH:12]1)=[O:32].[CH3:35][CH2:36][OH:37].[Na+:34].[OH-:33]>>[O:3]=[C:4]([CH2:5][O:6][c:7]1[c:8]([C:20]([NH:21][CH2:22][c:23]2[c:24]([F:30])[cH:25][c:26]([Br:29])[cH:27][cH:28]2)=[O:31])[cH:9][c:10]([N:14]2[CH2:15][CH2:16][O:17][CH2:18][CH2:19]2)[c:11]([F:13])[cH:12]1)[OH:32]Participants
5
Sources & evidence
- ORD record
- ord-27076ddf003949e18133ec518a60187b
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (9/10)
Reaction notes
Loading…