Hydrochloric Acid → 2-Chloro-4-[[(3-hydroxybenzyl)amino]carbonyl]benzoic acid methyl ester

HRID 168172

Reaction equation

HRID 168172 reaction equation
[CH3:1][O:2][C:3]([c:4]1[c:5]([Cl:20])[cH:6][c:7]([C:10]([O:12][N:11]2[C:13](=[O:14])[CH2:15][CH2:16][C:17]2=[O:18])=[O:19])[cH:8][cH:9]1)=[O:21].[CH3:32][CH2:33][N:34]([CH2:35][CH3:36])[CH2:37][CH3:38].[CH3:39][N:40]([CH3:41])[CH:42]=[O:43].[ClH:22].[OH:23][c:24]1[cH:25][c:26]([CH2:27][NH2:28])[cH:29][cH:30][cH:31]1>>[CH3:1][O:2][C:3]([c:4]1[c:5]([Cl:20])[cH:6][c:7]([C:10](=[O:12])[NH:28][CH2:27][c:26]2[cH:25][c:24]([OH:23])[cH:31][cH:30][cH:29]2)[cH:8][cH:9]1)=[O:21]

Participants

6

Reactant 5

HCID 313Hydrochloric AcidHCID 6228DimethylformamideHCID 8471TriethylamineHCID 7358943-(Aminomethyl)phenolHCID 235607681-[[3-Chloro-4-(methoxycarbonyl)benzoyl]oxy]-2,5-pyrrolidinedione

Product 1

HCID 235607812-Chloro-4-[[(3-hydroxybenzyl)amino]carbonyl]benzoic acid methyl ester

Sources & evidence

ORD record
ord-139a1f5d32bf4a8bbb14854a4103ac13
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (9/10)

Linked notes

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