Chloride → HCID 22054230, compound

HRID 2344326Notes

Reaction equation

HRID 2344326 reaction equation
[CH2:56]([Cl:57])[Cl:58].[CH3:12][CH2:13][N:14]([CH2:15][CH3:16])[CH2:17][CH3:18].[CH3:1][O:2][c:3]1[c:4]([NH2:5])[cH:6][c:7]([O:10][CH3:11])[cH:8][cH:9]1.[CH3:28][O:29][C:30]1=[C:35]([O:36][CH3:37])[C:34](=[O:38])[C:33]([CH2:39][c:40]2[cH:41][cH:42][c:43]([O:49][C:50]([CH3:51])=[O:52])[c:44]([C:45](=[O:46])[OH:47])[cH:48]2)=[C:32]([CH3:53])[C:31]1=[O:54].[Cl-:19].[Cl:20][CH:21]1[N:22]([CH3:23])[CH2:24][CH2:25][NH+:26]1[CH3:27].[OH2:55]>>[CH3:1][O:2][c:3]1[c:4]([NH:5][C:45]([c:44]2[c:43]([O:49][C:50]([CH3:51])=[O:52])[cH:42][cH:41][c:40]([CH2:39][C:33]3=[C:32]([CH3:53])[C:31](=[O:54])[C:30]([O:29][CH3:28])=[C:35]([O:36][CH3:37])[C:34]3=[O:38])[cH:48]2)=[O:46])[cH:6][c:7]([O:10][CH3:11])[cH:8][cH:9]1

Participants

8

Reactant 7

HCID 312ChlorideHCID 962WaterHCID 6344DichloromethaneHCID 76132,5-DimethoxyanilineHCID 8471TriethylamineHCID 220542715-(5,6-Dimethoxy-3-methyl-1,4-benzoquinon-2-yl)methyl-2-acetoxybenzoic AcidHCID 575014672-Chloro-1,3-dimethylimidazolidin-1-ium

Product 1

HCID 22054230HCID 22054230, compound

Sources & evidence

ORD record
ord-a35d3e37160045d38fdd031ec7808bf2
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (10/10)

Reaction notes

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