Chloride → 3-methoxycarbonylpropanoic acid N-butyl-N-(2'-cyanobiphenyl-4-ylmethyl)-amide
Reaction equation
[CH2:11]([CH2:12][CH2:13][CH3:14])[NH:15][CH2:16][c:17]1[cH:18][cH:19][c:20](-[c:23]2[c:24]([C:29]#[N:30])[cH:25][cH:26][cH:27][cH:28]2)[cH:21][cH:22]1.[CH3:2][O:3][C:4]([CH2:5][CH2:6][C:7](=[O:8])[OH:9])=[O:10].[CH3:32][CH2:33][O:34][C:35](=[O:36])[CH3:37].[Cl-:1].[OH2:31]>>[CH3:2][O:3][C:4]([CH2:5][CH2:6][C:7](=[O:8])[N:15]([CH2:11][CH2:12][CH2:13][CH3:14])[CH2:16][c:17]1[cH:18][cH:19][c:20](-[c:23]2[c:24]([C:29]#[N:30])[cH:25][cH:26][cH:27][cH:28]2)[cH:21][cH:22]1)=[O:10]Participants
6
Sources & evidence
- ORD record
- ord-659337baa4a6494caaf651a280682c47
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (7/10)
Reaction notes
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