Benzene → HCID 178497094, compound
Reaction equation
[CH3:25][O-:26].[CH:1]1([CH2:5][N:6]2[CH:7]3[C:8]4([OH:24])[CH2:9][CH2:10][CH2:11][CH2:12][C:13]4([c:14]4[cH:15][c:16]([OH:21])[cH:17][cH:18][c:19]4[CH2:20]3)[CH2:22][CH2:23]2)[CH2:2][CH2:3][CH2:4]1.[Cl:28][O:29][CH3:30].[Na+:27].[cH:31]1[cH:32][cH:33][cH:34][cH:35][cH:36]1>>[CH:1]1([CH2:5][N:6]2[CH:7]3[C:8]4([OH:24])[CH2:9][CH2:10][CH2:11][CH2:12][C:13]4([c:14]4[cH:15][c:16]([O:21][CH2:25][O:29][CH3:30])[cH:17][cH:18][c:19]4[CH2:20]3)[CH2:22][CH2:23]2)[CH2:2][CH2:3][CH2:4]1Participants
6
Sources & evidence
- ORD record
- ord-dab4b1e38a934b088666525187b0b2d0
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (4/10)
Reaction notes
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