Hydrochloric Acid → HCID 178435729, compound

HRID 145221Notes

Reaction equation

HRID 145221 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:35](=[O:36])[NH:37][c:38]2[c:39]([Cl:48])[cH:40][c:41]([C:42](=[O:43])[O:44][CH3:45])[cH:46][cH:47]2)[CH2:25][CH2:26][CH:27]1[c:28]1[c:29]([F:34])[cH:30][cH:31][cH:32][cH:33]1.[CH3:52][OH:53].[ClH:51].[Na+:50].[OH-:49]>>[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:35](=[O:36])[NH:37][c:38]2[c:39]([Cl:48])[cH:40][c:41]([C:42](=[O:43])[OH:44])[cH:46][cH:47]2)[CH2:25][CH2:26][CH:27]1[c:28]1[c:29]([F:34])[cH:30][cH:31][cH:32][cH:33]1

Participants

6

Sources & evidence

ORD record
ord-20b969651d244a6f8efada3891471d9e
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (9/10)

Reaction notes

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