Water → HCID 54206983, compound

HRID 1543404Notes

Reaction equation

HRID 1543404 reaction equation
[C:23]([Cl:24])(=[O:25])[O:26][CH2:27][CH3:28].[CH2:52]([Cl:53])[Cl:54].[CH3:16][CH2:17][N:18]([CH2:19][CH3:20])[CH2:21][CH3:22].[CH3:1][n:2]1[cH:3][cH:4][c:5]2[cH:6][cH:7][c:8]([CH:11]=[CH:12][C:13](=[O:14])[OH:15])[cH:9][c:10]12.[N:31]1([CH:37]2[c:38]3[c:39]([cH:48][cH:49][cH:50][cH:51]3)[CH2:40][CH2:41][c:42]3[n:43][cH:44][cH:45][cH:46][c:47]32)[CH2:32][CH2:33][NH:34][CH2:35][CH2:36]1.[OH2:29].[OH2:30].[OH2:55]>>[CH3:1][n:2]1[cH:3][cH:4][c:5]2[cH:6][cH:7][c:8]([CH:11]=[CH:12][C:13](=[O:15])[N:34]3[CH2:33][CH2:32][N:31]([CH:37]4[c:38]5[c:39]([cH:48][cH:49][cH:50][cH:51]5)[CH2:40][CH2:41][c:42]5[n:43][cH:44][cH:45][cH:46][c:47]54)[CH2:36][CH2:35]3)[cH:9][c:10]12

Participants

7

Reactant 6

HCID 962Water3×HCID 6344DichloromethaneHCID 8471TriethylamineHCID 10928Ethyl chloroformateHCID 14835672HCID 14835672, compoundHCID 54173208HCID 54173208, compound

Product 1

HCID 54206983HCID 54206983, compound

Sources & evidence

ORD record
ord-ee8a14afaad14485bdad1ea6509c06cf
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (1/10)

Reaction notes

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