Sodium ion → HCID 22100695, compound

HRID 110106Notes

Reaction equation

HRID 110106 reaction equation
[Br:41][CH2:42][C:43](=[O:44])[O:45][CH2:46][CH3:47].[CH3:1][c:2]1[n:3][c:4]2[c:5]([n:6]1[CH2:7][c:8]1[cH:9][cH:10][c:11]([C:18]#[N:19])[c:12]3[cH:13][cH:14][cH:15][cH:16][c:17]13)[cH:20][c:21]([O:25][CH:26]1[CH2:27][CH2:28][N:29]([C:32](=[O:33])[O:34][C:35]([CH3:36])([CH3:37])[CH3:38])[CH2:30][CH2:31]1)[c:22]([OH:24])[cH:23]2.[CH3:48][CH2:49][O:50][C:51](=[O:52])[CH3:53].[H-:40].[Na+:39].[O:54]=[CH:55][N:56]([CH3:57])[CH3:58].[OH2:59]>>[CH3:1][c:2]1[n:3][c:4]2[c:5]([n:6]1[CH2:7][c:8]1[cH:9][cH:10][c:11]([C:18]#[N:19])[c:12]3[cH:13][cH:14][cH:15][cH:16][c:17]13)[cH:20][c:21]([O:25][CH:26]1[CH2:27][CH2:28][N:29]([C:32](=[O:33])[O:34][C:35]([CH3:36])([CH3:37])[CH3:38])[CH2:30][CH2:31]1)[c:22]([O:24][CH2:42][C:43](=[O:44])[O:45][CH2:46][CH3:47])[cH:23]2

Participants

8

Reactant 7

HCID 923Sodium ionHCID 962WaterHCID 6228DimethylformamideHCID 7748Ethyl bromoacetateHCID 8857Ethyl AcetateHCID 166653HydrideHCID 22100737HCID 22100737, compound

Product 1

HCID 22100695HCID 22100695, compound

Sources & evidence

ORD record
ord-04c01f7b6f7c4bdeb2be9b66d66a27d1
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (2/10)

Reaction notes

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