Toluene → HCID 20466799, compound
Reaction equation
[Br:26][CH2:27][CH2:28][Br:29].[CH2:1]([CH2:2][CH2:3][CH2:4][CH2:5][CH2:6][CH2:7][CH2:8][CH2:9][CH2:10][CH2:11][CH3:12])[CH:13]([C:14]#[N:15])[c:16]1[cH:17][c:18]([O:24][CH3:25])[c:19]([O:22][CH3:23])[cH:20][cH:21]1.[CH3:38][c:39]1[cH:40][cH:41][cH:42][cH:43][cH:44]1.[CH:30]([N-:31][CH:32]([CH3:33])[CH3:34])([CH3:35])[CH3:36].[Li+:37]>>[CH2:1]([CH2:2][CH2:3][CH2:4][CH2:5][CH2:6][CH2:7][CH2:8][CH2:9][CH2:10][CH2:11][CH3:12])[C:13]([C:14]#[N:15])([c:16]1[cH:17][c:18]([O:24][CH3:25])[c:19]([O:22][CH3:23])[cH:20][cH:21]1)[CH2:28][CH2:27][Br:26]Participants
6
Sources & evidence
- ORD record
- ord-e148038b8664448f8ee7396f2a1d6ad1
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (1/10)
Reaction notes
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