Acetone → HCID 10202244, compound

HRID 200001Notes

Reaction equation

HRID 200001 reaction equation
[C:15](=[O:16])([O-:17])[O-:18].[CH2:23]([c:24]1[cH:25][cH:26][cH:27][cH:28][cH:29]1)[c:30]1[n:31][c:32]([C:37]([CH3:38])([CH3:39])[CH3:40])[o:33][c:34]1[CH2:35][Cl:36].[CH3:1][O:2][c:3]1[c:4]([N:9]2[CH2:10][CH2:11][NH:12][CH2:13][CH2:14]2)[cH:5][cH:6][cH:7][cH:8]1.[CH3:41][C:42](=[O:43])[CH3:44].[I-:22].[K+:19].[K+:20].[K+:21]>>[CH3:1][O:2][c:3]1[c:4]([N:9]2[CH2:10][CH2:11][N:12]([CH2:35][c:34]3[c:30]([CH2:23][c:24]4[cH:25][cH:26][cH:27][cH:28][cH:29]4)[n:31][c:32]([C:37]([CH3:38])([CH3:39])[CH3:40])[o:33]3)[CH2:13][CH2:14]2)[cH:5][cH:6][cH:7][cH:8]1

Participants

7

Reactant 6

HCID 180AcetoneHCID 813Potassium Cation3×HCID 13461-(2-Methoxyphenyl)piperazineHCID 19660Carbonate IonHCID 30165Iodide IonHCID 21197965HCID 21197965, compound

Product 1

HCID 10202244HCID 10202244, compound

Sources & evidence

ORD record
ord-8c66253600574769bd1948761e0d4902
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (6/10)

Reaction notes

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