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Ethanol → 4-(2-[1-benzhydryl-5-chloro-2-(2-{[(2-hydroxyphenyl)sulfonyl]amino}ethyl)-1H-indol-3-yl]ethoxy}benzoic acid

HRID 96406
Notes
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Reaction equation

HRID 96406 reaction equation
[CH3:55][OH:56].[CH3:57][CH2:58][OH:59].[CH:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)([c:8]1[cH:9][cH:10][cH:11][cH:12][cH:13]1)[n:14]1[c:15]([CH2:36][CH2:37][NH:38][S:39](=[O:40])(=[O:41])[c:42]2[c:43]([O:48][CH2:49][C:50]([CH3:51])=[CH:52][CH:53]=[CH2:54])[cH:44][cH:45][cH:46][cH:47]2)[c:16]([CH2:24][CH2:25][O:26][c:27]2[cH:28][cH:29][c:30]([C:31](=[O:32])[OH:33])[cH:34][cH:35]2)[c:17]2[cH:18][c:19]([Cl:23])[cH:20][cH:21][c:22]12>>[CH:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)([c:8]1[cH:9][cH:10][cH:11][cH:12][cH:13]1)[n:14]1[c:15]([CH2:36][CH2:37][NH:38][S:39](=[O:40])(=[O:41])[c:42]2[c:43]([OH:48])[cH:44][cH:45][cH:46][cH:47]2)[c:16]([CH2:24][CH2:25][O:26][c:27]2[cH:28][cH:29][c:30]([C:31](=[O:32])[OH:33])[cH:34][cH:35]2)[c:17]2[cH:18][c:19]([Cl:23])[cH:20][cH:21][c:22]12
ParticipantsSources & evidenceReaction notes

Participants

4

Reactant 3

HCID 702EthanolHCID 887MethanolHCID 865889134-[2-(1-Benzhydryl-5-chloro-2-{2-[2-(2-methyl-penta-2,4-dienyloxy)-benzenesulfonylamino]-ethyl}-1H-indol-3-yl)-ethoxy]-benzoic acid

Product 1

HCID 219622474-(2-[1-benzhydryl-5-chloro-2-(2-{[(2-hydroxyphenyl)sulfonyl]amino}ethyl)-1H-indol-3-yl]ethoxy}benzoic acid

Sources & evidence

ORD record
ord-8053171dd79e41a289a32143ac8236b9
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