Sodium ion → HCID 68488383, compound

HRID 1148458Notes

Reaction equation

HRID 1148458 reaction equation
[C:1]([O:2][C:6](=[O:3])[N:8]1[CH2:9][CH2:10][C:11](=[CH:14][CH2:15][CH2:16][CH3:17])[CH2:12][CH2:13]1)([CH3:4])([CH3:5])[CH3:7].[C:34](=[O:35])([O-:36])[O-:37].[Cl:18][CH2:19][CH2:20][CH2:21][n:22]1[c:23](=[O:31])[nH:24][c:25]2[c:26]1[cH:27][cH:28][cH:29][cH:30]2.[I-:33].[Na+:32].[Na+:38].[Na+:39].[OH2:47].[OH:40][C:41]([C:42]([F:43])([F:44])[F:45])=[O:46]>>[CH2:6]([N:8]1[CH2:9][CH2:10][C:11](=[CH:14][CH2:15][CH2:16][CH3:17])[CH2:12][CH2:13]1)[CH2:20][CH2:21][n:22]1[c:23](=[O:31])[nH:24][c:25]2[c:26]1[cH:27][cH:28][cH:29][cH:30]2

Participants

8

Reactant 7

HCID 923Sodium ion3×HCID 962WaterHCID 6422Trifluoroacetic acidHCID 19660Carbonate IonHCID 30165Iodide IonHCID 18104191-(3-chloropropyl)-1,3-dihydro-2H-benzimidazol-2-oneHCID 22970158tert-Butyl 4-butylidenepiperidine-1-carboxylate

Product 1

HCID 68488383HCID 68488383, compound

Sources & evidence

ORD record
ord-73d225bbdff942d183dd0656b747bbda
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (7/10)

Reaction notes

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