8-Phenyloctan-1-amine → N-(8-phenyloctyl)-3-(4-methoxyphenyl)-5-(3-trifluoromethylphenyl)-4-(2-hydroxyethoxy)benzamide

HRID 87856

Reaction equation

HRID 87856 reaction equation
[CH2:1]([O:2][C:4]([c:5]1[cH:6][c:7](-[c:25]2[cH:26][cH:27][c:28]([O:31][CH3:32])[cH:29][cH:30]2)[c:8]([O:21][CH2:22][CH2:23][OH:24])[c:9](-[c:11]2[cH:12][c:13]([C:17]([F:18])([F:19])[F:20])[cH:14][cH:15][cH:16]2)[cH:10]1)=[O:33])[CH3:3].[c:34]1([CH2:40][CH2:41][CH2:42][CH2:43][CH2:44][CH2:45][CH2:46][CH2:47][NH2:48])[cH:35][cH:36][cH:37][cH:38][cH:39]1>>[C:4]([c:5]1[cH:6][c:7](-[c:25]2[cH:26][cH:27][c:28]([O:31][CH3:32])[cH:29][cH:30]2)[c:8]([O:21][CH2:22][CH2:23][OH:24])[c:9](-[c:11]2[cH:12][c:13]([C:17]([F:18])([F:19])[F:20])[cH:14][cH:15][cH:16]2)[cH:10]1)(=[O:33])[NH:48][CH2:47][CH2:46][CH2:45][CH2:44][CH2:43][CH2:42][CH2:41][CH2:40][c:34]1[cH:35][cH:36][cH:37][cH:38][cH:39]1

Participants

3

Reactant 2

HCID 1455568-Phenyloctan-1-amineHCID 536745433-(4-Methoxyphenyl)-5-(3-trifluoromethylphenyl)4-(2-hydroxyethoxy)benzoic acid ethyl ester

Product 1

HCID 22237651N-(8-phenyloctyl)-3-(4-methoxyphenyl)-5-(3-trifluoromethylphenyl)-4-(2-hydroxyethoxy)benzamide

Sources & evidence

ORD record
ord-5f72cdf571bb40fc839128eb3b77c288
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (2/10)

Linked notes

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