Chloride → HCID 90860777, compound

HRID 2348739Notes

Reaction equation

HRID 2348739 reaction equation
[Br:39][CH2:40][C:41](=[O:42])[O:43][CH2:44][CH3:45].[CH2:47]([N+:48]([CH2:49][CH3:50])([CH2:51][CH3:52])[CH2:53][CH3:54])[c:55]1[cH:56][cH:57][cH:58][cH:59][cH:60]1.[CH3:61][C:62](=[O:63])[CH2:64][CH3:65].[CH3:66][CH2:67][O:68][C:69]([CH3:70])=[O:71].[Cl-:46].[K+:33].[K+:34].[O-:35][C:36]([O-:37])=[O:38].[c:1]1([CH:7]([c:8]2[cH:9][cH:10][c:11](=[O:26])[n:12]([CH2:14][CH:15]=[CH:16][c:17]3[c:18]4[cH:19][cH:20][nH:21][c:22]4[cH:23][cH:24][cH:25]3)[cH:13]2)[c:27]2[cH:28][cH:29][cH:30][cH:31][cH:32]2)[cH:2][cH:3][cH:4][cH:5][cH:6]1>>[c:1]1([CH:7]([c:8]2[cH:9][cH:10][c:11](=[O:26])[n:12]([CH2:14][CH:15]=[CH:16][c:17]3[c:18]4[cH:19][cH:20][n:21]([CH2:40][C:41](=[O:42])[O:43][CH2:44][CH3:45])[c:22]4[cH:23][cH:24][cH:25]3)[cH:13]2)[c:27]2[cH:28][cH:29][cH:30][cH:31][cH:32]2)[cH:2][cH:3][cH:4][cH:5][cH:6]1

Participants

9

Reactant 8

HCID 312ChlorideHCID 813Potassium Cation2×HCID 6569Methyl Ethyl KetoneHCID 7748Ethyl bromoacetateHCID 8857Ethyl AcetateHCID 17208BenzyltriethylammoniumHCID 19660Carbonate IonHCID 68535387HCID 68535387, compound

Product 1

HCID 90860777HCID 90860777, compound

Sources & evidence

ORD record
ord-0da3ab1fe966495893e521dffc73ae20
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (10/10)

Reaction notes

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