Chloride → HCID 22054320, compound
Reaction equation
[CH2:55]([Cl:56])[Cl:57].[CH3:11][CH2:12][N:13]([CH2:14][CH3:15])[CH2:16][CH3:17].[CH3:27][O:28][C:29]1=[C:34]([O:35][CH3:36])[C:33](=[O:37])[C:32]([CH2:38][c:39]2[cH:40][cH:41][c:42]([O:48][C:49]([CH3:50])=[O:51])[c:43]([C:44](=[O:45])[OH:46])[cH:47]2)=[C:31]([CH3:52])[C:30]1=[O:53].[Cl-:18].[Cl:19][CH:20]1[N:21]([CH3:22])[CH2:23][CH2:24][NH+:25]1[CH3:26].[N+:1](=[O:2])([O-:3])[c:4]1[cH:5][c:6]([NH2:7])[cH:8][cH:9][cH:10]1.[OH2:54]>>[N+:1](=[O:2])([O-:3])[c:4]1[cH:5][c:6]([NH:7][C:44]([c:43]2[c:42]([O:48][C:49]([CH3:50])=[O:51])[cH:41][cH:40][c:39]([CH2:38][C:32]3=[C:31]([CH3:52])[C:30](=[O:53])[C:29]([O:28][CH3:27])=[C:34]([O:35][CH3:36])[C:33]3=[O:37])[cH:47]2)=[O:45])[cH:8][cH:9][cH:10]1Participants
8
Sources & evidence
- ORD record
- ord-f1b0d31d8f3442bb96972572e8efcef6
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (10/10)
Reaction notes
Loading…