Acetone → HCID 54439373, compound
Reaction equation
[CH3:37][C:38](=[O:39])[CH3:40].[Cl:1][c:2]1[cH:3][cH:4][c:5]([C:8]#[C:9][CH2:10][CH2:11][CH2:12][CH2:13][NH:14][c:15]2[cH:16][cH:17][c:18]([CH2:21][C:22](=[O:23])[O:24][CH2:25][CH3:26])[cH:19][cH:20]2)[cH:6][cH:7]1.[cH:27]1[cH:28][c:29]2[c:30]([n:31][cH:32][cH:33][cH:34]2)[cH:35][cH:36]1>>[Cl:1][c:2]1[cH:3][cH:4][c:5]([CH:8]=[CH:9][CH2:10][CH2:11][CH2:12][CH2:13][NH:14][c:15]2[cH:16][cH:17][c:18]([CH2:21][C:22](=[O:23])[O:24][CH2:25][CH3:26])[cH:19][cH:20]2)[cH:6][cH:7]1Participants
4
Sources & evidence
- ORD record
- ord-f31383a40fe04d70a161cea86a2d05ec
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (4/10)
Reaction notes
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