Ethanol → Benzoic acid, 4-(3-aminopropoxy)-, ethyl ester
Reaction equation
[CH2:1]([CH3:2])[O:3][C:4]([c:5]1[cH:6][cH:7][c:8]([O:11][CH2:12][CH2:13][CH2:14][N:15]2[C:16](=[O:17])[c:18]3[c:19]([cH:20][cH:21][cH:22][cH:23]3)[C:24]2=[O:25])[cH:9][cH:10]1)=[O:26].[CH3:30][CH2:31][OH:32].[NH2:28][NH2:29].[OH2:27]>>[CH2:1]([CH3:2])[O:3][C:4]([c:5]1[cH:6][cH:7][c:8]([O:11][CH2:12][CH2:13][CH2:14][NH2:15])[cH:9][cH:10]1)=[O:26]Participants
5
Sources & evidence
- ORD record
- ord-65ee8982f18c4a9aaa1d29d49d746b65
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (10/10)
Reaction notes
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