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Potassium Cation → 2-methyl-2-{1-[3-(7-propyl-3-trifluoromethyl-benzo[d]isoxazol-6-yloxy)-propyl]-1H-indol-4-yloxy}-propionic acid ethyl ester

HRID 124301
Notes
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Reaction equation

HRID 124301 reaction equation
[C:40](=[O:41])([O-:42])[O-:43].[CH2:1]([CH3:2])[O:3][C:4]([C:5]([CH3:6])([CH3:7])[O:8][c:9]1[c:10]2[cH:11][cH:12][n:13]([CH2:18][CH2:19][CH2:20][Cl:21])[c:14]2[cH:15][cH:16][cH:17]1)=[O:22].[CH2:23]([CH2:24][CH3:25])[c:26]1[c:27]([OH:39])[cH:28][cH:29][c:30]2[c:31]([C:35]([F:36])([F:37])[F:38])[n:32][o:33][c:34]12.[I-:47].[K+:44].[K+:45].[K+:46].[O:49]=[CH:50][N:51]([CH3:52])[CH3:53].[OH2:48]>>[CH2:1]([CH3:2])[O:3][C:4]([C:5]([CH3:6])([CH3:7])[O:8][c:9]1[c:10]2[cH:11][cH:12][n:13]([CH2:18][CH2:19][CH2:20][O:39][c:27]3[c:26]([CH2:23][CH2:24][CH3:25])[c:34]4[c:30]([cH:29][cH:28]3)[c:31]([C:35]([F:36])([F:37])[F:38])[n:32][o:33]4)[c:14]2[cH:15][cH:16][cH:17]1)=[O:22]
ParticipantsSources & evidenceReaction notes

Participants

8

Reactant 7

HCID 813Potassium Cation3×HCID 962WaterHCID 6228DimethylformamideHCID 19660Carbonate IonHCID 30165Iodide IonHCID 160908732-[1-(3-chloropropyl)-1H-indol-4-yloxy]-2-methylpropionic acid ethyl ester
HCID 135800812
7-Propyl-3-(trifluoromethyl)benzo[d]isoxazol-6-ol

Product 1

HCID 689667202-methyl-2-{1-[3-(7-propyl-3-trifluoromethyl-benzo[d]isoxazol-6-yloxy)-propyl]-1H-indol-4-yloxy}-propionic acid ethyl ester

Sources & evidence

ORD record
ord-01e40285e6b64ae6919b9fccbb449bc4
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (2/10)
DOI
10.1039/C8SC04228D

Reaction notes

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On this pageParticipantsSources & evidenceReaction notes