Toluene → HCID 14777050, compound
Reaction equation
[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6](=[O:7])[N:8]1[C:9]([CH3:48])([CH3:49])[O:10][CH:11]([CH:20]([CH:21]([C:22](=[O:23])[N:24]2[C:25](=[O:36])[O:26][CH:27]([c:30]3[cH:31][cH:32][cH:33][cH:34][cH:35]3)[CH:28]2[CH3:29])[CH:37]([CH3:38])[CH3:39])[O:40][S:41]([n:42]2[cH:43][cH:44][n:45][cH:46]2)=[O:47])[CH:12]1[CH2:13][CH:14]1[CH2:15][CH2:16][CH2:17][CH2:18][CH2:19]1.[CH2:50]([SnH:51]([CH2:52][CH2:53][CH2:54][CH3:55])[CH2:56][CH2:57][CH2:58][CH3:59])[CH2:60][CH2:61][CH3:62].[CH3:63][c:64]1[cH:65][cH:66][cH:67][cH:68][cH:69]1>>[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6](=[O:7])[N:8]1[C:9]([CH3:48])([CH3:49])[O:10][CH:11]([CH2:20][CH:21]([C:22](=[O:23])[N:24]2[C:25](=[O:36])[O:26][CH:27]([c:30]3[cH:31][cH:32][cH:33][cH:34][cH:35]3)[CH:28]2[CH3:29])[CH:37]([CH3:38])[CH3:39])[CH:12]1[CH2:13][CH:14]1[CH2:15][CH2:16][CH2:17][CH2:18][CH2:19]1Participants
4
Sources & evidence
- ORD record
- ord-8e132308563f4ddd8b5288362a0f19af
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (2/10)
Reaction notes
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