Hydrochloric Acid → HCID 178472788, compound

HRID 2128190Notes

Reaction equation

HRID 2128190 reaction equation
[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6](=[O:7])[N:8]([CH:9]([CH3:10])[c:11]1[cH:12][cH:13][cH:14][c:15]2[cH:16][cH:17][cH:18][cH:19][c:20]12)[CH2:21][CH:22]1[CH2:23][N:24]([C:33]([CH2:34][CH2:35][C:36](=[O:37])[OH:38])=[O:39])[CH2:25][CH:26]1[c:27]1[cH:28][cH:29][cH:30][cH:31][cH:32]1.[CH2:41]([CH3:42])[O:43][C:44]([CH2:45][NH2:46])=[O:47].[CH3:58][CH2:59][N:60]([CH2:61][CH3:62])[CH2:63][CH3:64].[Cl:65][CH2:66][Cl:67].[ClH:40].[OH:48][n:49]1[c:50]2[c:51]([cH:52][cH:53][cH:54][cH:55]2)[n:56][n:57]1>>[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6](=[O:7])[N:8]([CH:9]([CH3:10])[c:11]1[cH:12][cH:13][cH:14][c:15]2[cH:16][cH:17][cH:18][cH:19][c:20]12)[CH2:21][CH:22]1[CH2:23][N:24]([C:33]([CH2:34][CH2:35][C:36](=[O:37])[NH:46][CH2:45][C:44]([O:43][CH2:41][CH3:42])=[O:47])=[O:39])[CH2:25][CH:26]1[c:27]1[cH:28][cH:29][cH:30][cH:31][cH:32]1

Participants

7

Sources & evidence

ORD record
ord-c19fbcc85d7c4efeb268cfaf3dee7cdf
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (4/10)

Reaction notes

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