Benzoyl chloride → HCID 70157733, compound
Reaction equation
[C:1]([CH3:3])([CH3:4])([O:5][C:6](=[O:2])[NH:8][CH:9]1[CH2:10][CH:11]([CH2:20][N:21]2[CH2:22][CH2:23][CH:24]([N:27]([CH2:28][CH:29]=[CH2:30])[C:31](=[O:32])[NH:33][CH2:34][c:35]3[cH:36][cH:37][c:38]([N+:41](=[O:42])[O-:43])[cH:39][cH:40]3)[CH2:25][CH2:26]2)[CH:12]([c:14]2[cH:15][cH:16][cH:17][cH:18][cH:19]2)[CH2:13]1)[CH3:7].[C:44]([c:45]1[cH:46][cH:47][cH:48][cH:49][cH:50]1)([Cl:51])=[O:52]>>[O:5]=[C:6]([NH:8][CH:9]1[CH2:10][CH:11]([CH2:20][N:21]2[CH2:22][CH2:23][CH:24]([N:27]([CH2:28][CH:29]=[CH2:30])[C:31](=[O:32])[NH:33][CH2:34][c:35]3[cH:36][cH:37][c:38]([N+:41](=[O:42])[O-:43])[cH:39][cH:40]3)[CH2:25][CH2:26]2)[CH:12]([c:14]2[cH:15][cH:16][cH:17][cH:18][cH:19]2)[CH2:13]1)[c:45]1[cH:46][cH:47][cH:48][cH:49][cH:50]1Participants
3
Sources & evidence
- ORD record
- ord-db26916d58a045219ddb69d62665a9aa
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (10/10)
Reaction notes
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