HCID 11462234, compound → 4-(3,3-Dimethyl-3,4-dihydro-2H-benzo[b][1,4]dioxepin-7-ylethynyl)-N,N-dimethyl-benzamide
Reaction equation
[C:27](#[CH:28])[c:29]1[cH:30][cH:31][c:32]([C:33](=[O:34])[N:35]([CH3:36])[CH3:37])[cH:38][cH:39]1.[CH2:1]([O:2][C:3](=[O:4])[c:5]1[cH:6][cH:7][cH:8][c:9]([C:10]#[C:11][c:13]2[cH:14][c:15]3[c:16]([cH:24][cH:25]2)[O:17][CH2:18][C:19]([CH3:22])([CH3:23])[CH2:20][O:21]3)[cH:12]1)[CH3:26].[I:40][c:41]1[cH:42][cH:43][c:44]2[c:52]([cH:53]1)[O:51][CH2:50][C:47]([CH3:48])([CH3:49])[CH2:46][O:45]2>>[c:13]1([C:28]#[C:27][c:29]2[cH:30][cH:31][c:32]([C:33](=[O:34])[N:35]([CH3:36])[CH3:37])[cH:38][cH:39]2)[cH:14][c:15]2[c:16]([cH:24][cH:25]1)[O:17][CH2:18][C:19]([CH3:22])([CH3:23])[CH2:20][O:21]2Participants
4
Sources & evidence
- ORD record
- ord-20da8f7e187348b7861814e243082498
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (6/10)
Reaction notes
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