Hydrochloric Acid → Hydrochloric Acid

HRID 2313879Notes

Reaction equation

HRID 2313879 reaction equation
[C:1](=[O:2])([O-:3])[O-:4].[CH3:48][N:49]([CH3:50])[CH:51]=[O:52].[Cl:8][CH2:9][c:10]1[n:11][cH:12][cH:13][cH:14][cH:15]1.[ClH:7].[F:16][C:17]([c:18]1[cH:19][c:20]([C:21](=[O:22])[N:23]2[CH:24]([CH2:29][c:30]3[cH:31][c:32]([CH3:37])[c:33]([CH3:36])[cH:34][cH:35]3)[CH2:25][NH:26][CH2:27][CH2:28]2)[cH:38][c:39]([C:41]([F:42])([F:43])[F:44])[cH:40]1)([F:45])[F:46].[K+:5].[K+:6].[OH2:47]>>[CH2:9]([c:10]1[n:11][cH:12][cH:13][cH:14][cH:15]1)[N:26]1[CH2:25][CH:24]([CH2:29][c:30]2[cH:31][c:32]([CH3:37])[c:33]([CH3:36])[cH:34][cH:35]2)[N:23]([C:21]([c:20]2[cH:19][c:18]([C:17]([F:16])([F:45])[F:46])[cH:40][c:39]([C:41]([F:42])([F:43])[F:44])[cH:38]2)=[O:22])[CH2:28][CH2:27]1.[ClH:7].[ClH:8]

Participants

9

Sources & evidence

ORD record
ord-d75310abaf994bcc86182b4b24bf5841
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (10/10)

Reaction notes

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