Benzene → HCID 54335978, compound
Reaction equation
[C:31]([CH3:32])#[N:33].[CH3:28][CH2:29][O-:30].[Na+:27].[O:1]=[C:2]1[CH2:3][C:4]2=[C:5]([c:6]3[c:7]([cH:15][cH:16][cH:17][cH:18]3)[O:8][c:9]3[c:10]2[cH:11][cH:12][cH:13][cH:14]3)[CH2:19][CH2:20]1.[cH:21]1[cH:22][cH:23][cH:24][cH:25][cH:26]1>>[C:2]1(=[CH:32][C:31]#[N:33])[CH2:3][C:4]2=[C:5]([c:6]3[c:7]([cH:15][cH:16][cH:17][cH:18]3)[O:8][c:9]3[c:10]2[cH:11][cH:12][cH:13][cH:14]3)[CH2:19][CH2:20]1Participants
6
Sources & evidence
- ORD record
- ord-4428e0665450458fb7d359b4900c052c
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (2/10)
Reaction notes
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