Sodium ion → 6-(4-Chlorophenyl)-8-methoxy-1-methyl-4H-[1,2,4]triazolo[4,3-a][1,4]benzodiazepine-4-acetic acid

HRID 1562558Notes

Reaction equation

HRID 1562558 reaction equation
[CH2:32]1[O:33][CH2:34][CH2:35][CH2:36]1.[CH3:1][CH:2]([C:3](=[O:4])[O-:5])[CH:6]1[c:7]2[n:8]([c:26]([CH3:29])[n:27][n:28]2)-[c:9]2[c:10]([cH:20][c:21]([O:24][CH3:25])[cH:22][cH:23]2)[C:11]([c:13]2[cH:14][cH:15][c:16]([Cl:19])[cH:17][cH:18]2)=[N:12]1.[Na+:31].[OH-:30]>>[CH2:2]([C:3](=[O:4])[OH:5])[CH:6]1[c:7]2[n:8]([c:26]([CH3:29])[n:27][n:28]2)-[c:9]2[c:10]([cH:20][c:21]([O:24][CH3:25])[cH:22][cH:23]2)[C:11]([c:13]2[cH:14][cH:15][c:16]([Cl:19])[cH:17][cH:18]2)=[N:12]1

Participants

5

Reactant 4

HCID 923Sodium ionHCID 961HydroxideHCID 8028TetrahydrofuranHCID 178487046HCID 178487046, compound

Product 1

HCID 532613636-(4-Chlorophenyl)-8-methoxy-1-methyl-4H-[1,2,4]triazolo[4,3-a][1,4]benzodiazepine-4-acetic acid

Sources & evidence

ORD record
ord-9216611a15324e2a9726be58a131ed47
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (1/10)

Reaction notes

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