Water → HCID 58392230, compound
Reaction equation
[CH2:29]([Al+:30][CH2:31][CH:32]([CH3:33])[CH3:34])[CH:35]([CH3:36])[CH3:37].[Cl:1][c:2]1[cH:3][cH:4][c:5]([C:8]([CH2:9][C:10](=[O:11])[O:12][CH2:13][CH3:14])([CH3:15])[c:16]2[cH:17][nH:18][c:19]3[c:20]([CH2:25][S:26][CH3:27])[cH:21][cH:22][cH:23][c:24]23)[cH:6][cH:7]1.[Cl:44][CH2:45][Cl:46].[H-:28].[O:39]1[CH2:40][CH2:41][CH2:42][CH2:43]1.[OH2:38]>>[Cl:1][c:2]1[cH:3][cH:4][c:5]([C:8]([CH2:9][CH2:10][OH:11])([CH3:15])[c:16]2[cH:17][nH:18][c:19]3[c:20]([CH2:25][S:26][CH3:27])[cH:21][cH:22][cH:23][c:24]23)[cH:6][cH:7]1Participants
7
Sources & evidence
- ORD record
- ord-d64d44ae12024044b5f51758a223cc69
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (6/10)
Reaction notes
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