Ammonia → 3-Cyano-3-(3,4-dichlorophenyl)propionic acid
Reaction equation
[CH3:22][S:23](=[O:24])[CH3:25].[Cl:1][CH2:2][C:3](=[O:4])[O-:5].[Cl:7][c:8]1[cH:9][c:10]([CH2:15][C:16]#[N:17])[cH:11][cH:12][c:13]1[Cl:14].[NH2-:20].[NH3:18].[Na+:6].[Na:19].[Na:21]>>[CH2:2]([C:3](=[O:4])[OH:5])[CH:15]([c:10]1[cH:9][c:8]([Cl:7])[c:13]([Cl:14])[cH:12][cH:11]1)[C:16]#[N:17]Participants
8
Sources & evidence
- ORD record
- ord-52ad163a6a5244d1aa47c2e114f1f133
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (4/10)
Reaction notes
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