Chloride → (+)-Dimethyl 5-oxo-3-(2,4,6-trimethoxyphenyl)pyrrolidine-2,4-dicarboxylate

HRID 141573Notes

Reaction equation

HRID 141573 reaction equation
[CH3:36][CH2:37][O:38][C:39](=[O:40])[CH3:41].[Cl-:33].[N+:1]([CH:4]([CH:5]([CH:6]([C:7]([O:2][CH3:3])=[O:8])[C:11](=[O:12])[O:13][CH3:14])[c:15]1[c:16]([O:25][CH3:26])[cH:17][c:18]([O:23][CH3:24])[cH:19][c:20]1[O:21][CH3:22])[C:27](=[O:28])[O:29][CH3:30])([O-:9])=[O:10].[Na+:35].[OH-:34].[OH2:31].[OH2:32]>>[NH:1]1[CH:4]([C:27](=[O:28])[O:29][CH3:30])[CH:5]([c:15]2[c:16]([O:25][CH3:26])[cH:17][c:18]([O:23][CH3:24])[cH:19][c:20]2[O:21][CH3:22])[CH:6]([C:11](=[O:12])[O:13][CH3:14])[C:7]1=[O:8]

Participants

7

Reactant 6

HCID 312ChlorideHCID 923Sodium ionHCID 961HydroxideHCID 962Water2×HCID 8857Ethyl AcetateHCID 72254933(+)-Trimethyl 3-nitro-2-(2,4,6-trimethoxyphenyl)propane-1,1,3-tricarboxylate

Product 1

HCID 67164784(+)-Dimethyl 5-oxo-3-(2,4,6-trimethoxyphenyl)pyrrolidine-2,4-dicarboxylate

Sources & evidence

ORD record
ord-3543f96c6be04db4b4a9dac98ba4d225
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (9/10)

Reaction notes

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