Toluene → HCID 67067426, compound
Reaction equation
[CH2:1]([CH3:2])[O:3][C:4]([NH:5][CH:6]([C:7](=[O:8])[c:9]1[cH:10][c:11]2[c:15]([c:16]([C:18]#[N:19])[cH:17]1)[N:14]([CH2:20][CH2:21][CH2:22][O:23][Si:24]([CH3:25])([CH3:26])[C:27]([CH3:28])([CH3:29])[CH3:30])[CH2:13][CH2:12]2)[CH3:31])=[O:32].[CH2:33]([SiH:34]([CH2:35][CH3:36])[CH2:37][CH3:38])[CH3:39].[CH3:47][c:48]1[cH:49][cH:50][cH:51][cH:52][cH:53]1.[OH:40][C:41]([C:42]([F:43])([F:44])[F:45])=[O:46]>>[CH2:1]([CH3:2])[O:3][C:4]([NH:5][CH:6]([CH2:7][c:9]1[cH:10][c:11]2[c:15]([c:16]([C:18]#[N:19])[cH:17]1)[N:14]([CH2:20][CH2:21][CH2:22][O:23][Si:24]([CH3:25])([CH3:26])[C:27]([CH3:28])([CH3:29])[CH3:30])[CH2:13][CH2:12]2)[CH3:31])=[O:32]Participants
5
Sources & evidence
- ORD record
- ord-bc9e38415f5e4855a614ed2f07f4c868
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (10/10)
Reaction notes
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