Benzene → HCID 18427649, compound
Reaction equation
[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[O:8][c:9]1[cH:10][c:11]2[c:15]([cH:16][cH:17]1)[CH:14]([c:18]1[cH:19][c:20]3[c:21]([cH:22][cH:23]1)[O:24][CH2:25][O:26]3)[CH:13]([C:27](=[O:28])[O:29][CH3:30])[C:12]2=[O:31].[Cl:32][C:33]1=[C:44]([Cl:45])[C:42](=[O:43])[C:39]([C:40]#[N:41])=[C:36]([C:37]#[N:38])[C:34]1=[O:35].[cH:46]1[cH:47][cH:48][cH:49][cH:50][cH:51]1>>[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[O:8][c:9]1[cH:10][c:11]2[c:15]([cH:16][cH:17]1)[C:14]([c:18]1[cH:19][c:20]3[c:21]([cH:22][cH:23]1)[O:24][CH2:25][O:26]3)=[C:13]([C:27](=[O:28])[O:29][CH3:30])[C:12]2=[O:31]Participants
4
Sources & evidence
- ORD record
- ord-de9a72fccc7b44de8461b2c44225b41b
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (3/10)
Reaction notes
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