Ethanol → Sodium ion

HRID 313982Notes

Reaction equation

HRID 313982 reaction equation
[CH3:34][CH2:35][OH:36].[Cl:1][c:2]1[cH:3][c:4](-[c:11]2[n:12][c:13](-[c:16]3[cH:17][c:18]4[cH:19][n:20][n:21]([CH2:25][CH2:26][C:27](=[O:28])[O:29][CH2:30][CH3:31])[c:22]4[cH:23][cH:24]3)[n:14][o:15]2)[cH:5][cH:6][c:7]1[O:8][CH2:9][CH3:10].[Na+:33].[OH-:32]>>[Cl:1][c:2]1[cH:3][c:4](-[c:11]2[n:12][c:13](-[c:16]3[cH:17][c:18]4[cH:19][n:20][n:21]([CH2:25][CH2:26][C:27](=[O:28])[O-:29])[c:22]4[cH:23][cH:24]3)[n:14][o:15]2)[cH:5][cH:6][c:7]1[O:8][CH2:9][CH3:10].[Na+:33]

Participants

6

Reactant 4

HCID 702EthanolHCID 923Sodium ionHCID 961HydroxideHCID 59316698Ethyl 3-(5-{5-[3-chloro-4-(ethyloxy)phenyl]-1,2,4-oxadiazol-3-yl}-1H-indazol-1-yl)propanoate

Product 2

HCID 923Sodium ionHCID 593167723-[5-[5-(3-Chloro-4-ethoxyphenyl)-1,2,4-oxadiazol-3-yl]indazol-1-yl]propanoate

Sources & evidence

ORD record
ord-a29e81b9aed949faab63980065b56d40
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (8/10)

Reaction notes

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