Water → Eproxindine

HRID 2341200Notes

Reaction equation

HRID 2341200 reaction equation
[CH2:30]([CH3:31])[N:32]([CH2:33][CH3:34])[CH2:35][CH:36]([CH2:37][NH2:38])[OH:39].[CH2:41]([Cl:42])[Cl:43].[CH3:44][CH2:45][N:46]([CH2:47][CH3:48])[CH2:49][CH3:50].[Cl:2][c:3]1[cH:4][cH:5][cH:6][cH:7][n+:8]1[CH3:9].[I-:1].[OH2:40].[c:10]1(-[n:16]2[c:17]([C:27](=[O:28])[OH:29])[c:18]([O:25][CH3:26])[c:19]3[cH:20][cH:21][cH:22][cH:23][c:24]23)[cH:11][cH:12][cH:13][cH:14][cH:15]1>>[c:10]1(-[n:16]2[c:17]([C:27](=[O:28])[NH:38][CH2:37][CH:36]([CH2:35][N:32]([CH2:30][CH3:31])[CH2:33][CH3:34])[OH:39])[c:18]([O:25][CH3:26])[c:19]3[cH:20][cH:21][cH:22][cH:23][c:24]23)[cH:11][cH:12][cH:13][cH:14][cH:15]1

Participants

8

Reactant 7

HCID 962WaterHCID 6344DichloromethaneHCID 8471TriethylamineHCID 30165Iodide IonHCID 977491-Amino-3-(diethylamino)propan-2-olHCID 1670702-Chloro-1-methylpyridiniumHCID 131359883-Methoxy-1-phenyl-1H-indole-2-carboxylic acid

Product 1

HCID 54965Eproxindine

Sources & evidence

ORD record
ord-e072900904c543e68977f7a9dded5208
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (10/10)

Reaction notes

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