Sodium ion → 2-(1,3-Dioxoisoindol-2-yl)-3-(2-nitrophenyl)sulfanylpropanoic acid

HRID 1114948Notes

Reaction equation

HRID 1114948 reaction equation
[CH2:17]([O:18][C:19]([N:20]1[C:23](=[O:32])[c:24]2[c:25]([cH:28][cH:29][cH:30][cH:31]2)[C:26]1=[O:27])=[O:21])[CH3:22].[N+:1](=[O:2])([O-:3])[c:4]1[c:5]([S:10][CH2:11][CH:12]([NH2:13])[C:14](=[O:15])[OH:16])[cH:6][cH:7][cH:8][cH:9]1.[Na+:33].[Na+:34].[O-:35][C:36](=[O:37])[O-:38]>>[N+:1](=[O:2])([O-:3])[c:4]1[c:5]([S:10][CH2:11][CH:12]([N:13]2[C:23](=[O:32])[c:24]3[c:25]([cH:28][cH:29][cH:30][cH:31]3)[C:26]2=[O:27])[C:14](=[O:15])[OH:16])[cH:6][cH:7][cH:8][cH:9]1

Participants

5

Reactant 4

HCID 923Sodium ion2×HCID 19660Carbonate IonHCID 31187N-CarbethoxyphthalimideHCID 133750992-Amino-3-(2-nitrophenyl)sulfanyl-propanoic acid

Product 1

HCID 136052812-(1,3-Dioxoisoindol-2-yl)-3-(2-nitrophenyl)sulfanylpropanoic acid

Sources & evidence

ORD record
ord-47eab8c37f054fd6a6de08a7bf01ba4a
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (7/10)

Reaction notes

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