Ethyl Acetate → HCID 66878220, compound
Reaction equation
[CH3:1][O:2][C:3](=[O:4])[c:5]1[cH:6][cH:7][c:8]([N:11]2[C:12](=[O:24])[CH2:13][N:14]([C:17](=[O:18])[O:19][C:20]([CH3:21])([CH3:22])[CH3:23])[CH2:15][CH2:16]2)[cH:9][cH:10]1.[CH3:39][CH2:40][O:41][C:42](=[O:43])[CH3:44].[Cl:25][c:26]1[c:27](-[c:33]2[n:34][cH:35][cH:36][cH:37][cH:38]2)[cH:28][c:29]([NH2:30])[cH:31][cH:32]1>>[C:3](=[O:4])([c:5]1[cH:6][cH:7][c:8]([N:11]2[C:12](=[O:24])[CH2:13][N:14]([C:17](=[O:18])[O:19][C:20]([CH3:21])([CH3:22])[CH3:23])[CH2:15][CH2:16]2)[cH:9][cH:10]1)[NH:30][c:29]1[cH:28][c:27](-[c:33]2[n:34][cH:35][cH:36][cH:37][cH:38]2)[c:26]([Cl:25])[cH:32][cH:31]1Participants
4
Sources & evidence
- ORD record
- ord-b89d0b03985a4485aa77dac1cdbc0ee9
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (9/10)
Reaction notes
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