Benzene → HCID 14253322, compound
Reaction equation
[CH2:22]=[CH:23][C:24]#[N:25].[cH:1]1[cH:2][cH:3][cH:4][c:5]2[c:11]1[CH:10]=[CH:9][c:8]1[c:7]([cH:15][cH:14][cH:13][cH:12]1)[CH:6]2[CH:16]1[CH2:17][CH2:18][NH:19][CH2:20][CH2:21]1.[cH:26]1[cH:27][cH:28][cH:29][cH:30][cH:31]1>>[cH:1]1[cH:2][cH:3][cH:4][c:5]2[c:11]1[CH:10]=[CH:9][c:8]1[c:7]([cH:15][cH:14][cH:13][cH:12]1)[CH:6]2[CH:16]1[CH2:17][CH2:18][N:19]([CH2:22][CH2:23][C:24]#[N:25])[CH2:20][CH2:21]1Participants
4
Sources & evidence
- ORD record
- ord-442a4cc249c24f55a3d30276363a42a9
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (10/10)
Reaction notes
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