Acetone → HCID 66881744, compound

HRID 116374Notes

Reaction equation

HRID 116374 reaction equation
[Br:1][CH2:2][CH2:3][CH2:4][O:5][c:6]1[cH:7][c:8]([N+:30](=[O:31])[O-:32])[c:9]([C:14](=[O:15])[N:16]2[CH2:17][CH2:18][N:19]([c:22]3[c:23]([O:28][CH3:29])[cH:24][cH:25][cH:26][cH:27]3)[CH2:20][CH2:21]2)[cH:10][c:11]1[O:12][CH3:13].[CH3:33][O:34][c:35]1[c:36]([N:41]2[CH2:42][CH2:43][NH:44][CH2:45][CH2:46]2)[cH:37][cH:38][cH:39][cH:40]1.[CH3:53][C:54](=[O:55])[CH3:56].[K+:47].[K+:48].[O-:49][C:50]([O-:51])=[O:52]>>[CH2:2]([CH2:3][CH2:4][O:5][c:6]1[cH:7][c:8]([N+:30](=[O:31])[O-:32])[c:9]([C:14](=[O:15])[N:16]2[CH2:17][CH2:18][N:19]([c:22]3[c:23]([O:28][CH3:29])[cH:24][cH:25][cH:26][cH:27]3)[CH2:20][CH2:21]2)[cH:10][c:11]1[O:12][CH3:13])[N:44]1[CH2:43][CH2:42][N:41]([c:36]2[c:35]([O:34][CH3:33])[cH:40][cH:39][cH:38][cH:37]2)[CH2:46][CH2:45]1

Participants

6

Reactant 5

HCID 180AcetoneHCID 813Potassium Cation2×HCID 13461-(2-Methoxyphenyl)piperazineHCID 19660Carbonate IonHCID 66882500HCID 66882500, compound

Product 1

HCID 66881744HCID 66881744, compound

Sources & evidence

ORD record
ord-d384b67e1fb8470d81a61fec0ce984af
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (2/10)

Reaction notes

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