Water → HCID 23121807, compound
Reaction equation
[Cl:30][c:31]1[c:32]([CH2:33][Br:34])[cH:35][cH:36][cH:37][cH:38]1.[N+:1](=[O:2])([O-:3])[c:4]1[cH:5][cH:6][c:7]([NH:10][C:11]([c:12]2[cH:13][c:14]([O:19][CH2:20][c:21]3[c:22]([C:27]#[N:28])[cH:23][cH:24][cH:25][cH:26]3)[cH:15][c:16]([OH:18])[cH:17]2)=[O:29])[n:8][cH:9]1.[O:40]=[CH:41][N:42]([CH3:43])[CH3:44].[OH2:39]>>[N+:1](=[O:2])([O-:3])[c:4]1[cH:5][cH:6][c:7]([NH:10][C:11]([c:12]2[cH:13][c:14]([O:19][CH2:20][c:21]3[c:22]([C:27]#[N:28])[cH:23][cH:24][cH:25][cH:26]3)[cH:15][c:16]([O:18][CH2:33][c:32]3[c:31]([Cl:30])[cH:38][cH:37][cH:36][cH:35]3)[cH:17]2)=[O:29])[n:8][cH:9]1Participants
5
Sources & evidence
- ORD record
- ord-d274eb1b3e6345d4a3c65b5a55cb8254
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (2/10)
Reaction notes
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