Chloride → Nerbacadol

HRID 115769Notes

Reaction equation

HRID 115769 reaction equation
[CH2:1]1[CH2:2][CH2:3][NH:4][CH2:5][CH2:6]1.[CH3:10][c:11]1[c:12]([C:16](=[O:17])[OH:18])[cH:13][n:14][o:15]1.[Cl-:9].[Na+:8].[OH-:7].[OH2:19]>>[CH2:1]1[CH2:2][CH2:3][N:4]([C:16]([c:12]2[c:11]([CH3:10])[o:15][n:14][cH:13]2)=[O:17])[CH2:5][CH2:6]1

Participants

7

Reactant 6

HCID 312ChlorideHCID 923Sodium ionHCID 961HydroxideHCID 962WaterHCID 8082PiperidineHCID 14252405-Methylisoxazole-4-carboxylic acid

Product 1

HCID 65865Nerbacadol

Sources & evidence

ORD record
ord-c1f08a666631467d8c2d30e186223467
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (2/10)

Reaction notes

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