Chloride → N-(2-ethoxy-2-oxoethyl)-N-[3-[3-(4-methoxyphenoxy)propoxy]-5-(octadecyloxy)benzoyl]glycine ethyl ester

HRID 90466

Reaction equation

HRID 90466 reaction equation
[CH3:1][O:2][c:3]1[cH:4][cH:5][c:6]([O:7][CH2:8][CH2:9][CH2:10][O:11][c:12]2[cH:13][c:14]([C:15](=[O:16])[OH:17])[cH:18][c:19]([O:21][CH2:22][CH2:23][CH2:24][CH2:25][CH2:26][CH2:27][CH2:28][CH2:29][CH2:30][CH2:31][CH2:32][CH2:33][CH2:34][CH2:35][CH2:36][CH2:37][CH2:38][CH3:39])[cH:20]2)[cH:40][cH:41]1.[Cl-:42].[NH:43]([CH2:44][C:45](=[O:46])[O:47][CH2:48][CH3:49])[CH2:50][C:51](=[O:52])[O:53][CH2:54][CH3:55]>>[CH3:1][O:2][c:3]1[cH:4][cH:5][c:6]([O:7][CH2:8][CH2:9][CH2:10][O:11][c:12]2[cH:13][c:14]([C:15](=[O:16])[N:43]([CH2:44][C:45](=[O:46])[O:47][CH2:48][CH3:49])[CH2:50][C:51](=[O:52])[O:53][CH2:54][CH3:55])[cH:18][c:19]([O:21][CH2:22][CH2:23][CH2:24][CH2:25][CH2:26][CH2:27][CH2:28][CH2:29][CH2:30][CH2:31][CH2:32][CH2:33][CH2:34][CH2:35][CH2:36][CH2:37][CH2:38][CH3:39])[cH:20]2)[cH:40][cH:41]1

Participants

4

Reactant 3

HCID 312ChlorideHCID 80502Diethyl iminodiacetateHCID 190918333-[3-(4-Methoxyphenoxy)propoxy]-5-(octadecyloxy)benzoic acid

Product 1

HCID 19091759N-(2-ethoxy-2-oxoethyl)-N-[3-[3-(4-methoxyphenoxy)propoxy]-5-(octadecyloxy)benzoyl]glycine ethyl ester

Sources & evidence

ORD record
ord-7b90ec571b634c2d829d0a2e1b7c04b8
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (2/10)

Linked notes

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