Acetic Acid → HCID 21049087, compound
Reaction equation
[C:15]([CH3:16])([CH3:17])([CH3:18])[O:19][C:20](=[O:21])[N:22]1[CH:23]([CH:27]=[O:28])[CH2:24][CH2:25][CH2:26]1.[C:1]([O:2][BH-:3]([O:4][C:5](=[O:6])[CH3:7])[O:8][C:9](=[O:10])[CH3:11])(=[O:12])[CH3:13].[CH2:29]1[CH2:30][CH2:31][NH:32][CH2:33]1.[CH3:34][C:35](=[O:36])[OH:37].[Cl:38][CH2:39][Cl:40].[Na+:14]>>[C:15]([CH3:16])([CH3:17])([CH3:18])[O:19][C:20](=[O:21])[N:22]1[CH:23]([CH2:27][N:32]2[CH2:31][CH2:30][CH2:29][CH2:33]2)[CH2:24][CH2:25][CH2:26]1Participants
7
Sources & evidence
- ORD record
- ord-d2edfdcbbf8042278afcd8d4b09bf1a0
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (9/10)
Reaction notes
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