Benzene → HCID 178443349, compound
Reaction equation
[C:1]([CH2:2][CH2:3][CH2:4][CH2:5][CH2:6][CH2:7][CH2:8][CH2:9][CH:10]=[CH2:11])(=[O:12])[Cl:13].[CH2:14]([CH3:15])[C:16]12[CH:17]([OH:34])[CH2:18][CH2:19][CH:20]1[CH:21]1[CH:22]([CH2:23][CH2:24]2)[CH:25]2[CH2:26][CH2:27][C:28](=[O:33])[CH:29]=[C:30]2[CH2:31][CH2:32]1.[OH2:35].[cH:36]1[cH:37][cH:38][cH:39][cH:40][cH:41]1.[cH:42]1[cH:43][cH:44][n:45][cH:46][cH:47]1>>[C:1]([CH2:2][CH2:3][CH2:4][CH2:5][CH2:6][CH2:7][CH2:8][CH2:9][CH:10]=[CH2:11])(=[O:12])[O:34][CH:17]1[C:16]2([CH2:14][CH3:15])[CH:20]([CH2:19][CH2:18]1)[CH:21]1[CH:22]([CH2:23][CH2:24]2)[CH:25]2[CH2:26][CH2:27][C:28](=[O:33])[CH:29]=[C:30]2[CH2:31][CH2:32]1Participants
6
Sources & evidence
- ORD record
- ord-50c2292473364bd995aac28732c36886
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (10/10)
Reaction notes
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