Hydrochloric Acid → Hydrochloric Acid

HRID 1225414Notes

Reaction equation

HRID 1225414 reaction equation
[C:47]([O:48][CH2:49][CH3:50])(=[O:51])[CH3:52].[CH3:1][OH:2].[CH3:54][CH2:55][O:56][C:57](=[O:58])[CH3:59].[ClH:53].[O:3]1[CH2:4][CH2:5][O:6][c:7]2[c:8]1[cH:9][cH:10][c:11]([CH2:13][N:14]([C:15](=[O:16])[O:17][C:18]([CH3:19])([CH3:20])[CH3:21])[CH:22]1[CH2:23][CH2:24][N:25]([CH2:28][CH2:29][n:30]3[c:31](=[O:46])[cH:32][c:33]([CH3:45])[c:34]4[cH:35][cH:36][c:37](-[n:40]5[cH:41][n:42][cH:43][cH:44]5)[cH:38][c:39]34)[CH2:26][CH2:27]1)[cH:12]2>>[ClH:53].[O:3]1[CH2:4][CH2:5][O:6][c:7]2[c:8]1[cH:9][cH:10][c:11]([CH2:13][NH:14][CH:22]1[CH2:23][CH2:24][N:25]([CH2:28][CH2:29][n:30]3[c:31](=[O:46])[cH:32][c:33]([CH3:45])[c:34]4[cH:35][cH:36][c:37](-[n:40]5[cH:41][n:42][cH:43][cH:44]5)[cH:38][c:39]34)[CH2:26][CH2:27]1)[cH:12]2

Participants

6

Reactant 4

HCID 313Hydrochloric AcidHCID 887MethanolHCID 8857Ethyl Acetate2×HCID 59398007tert-butyl (2,3-dihydro-1,4-benzodioxin-6-ylmethyl)(1-(2-(7-(1H-imidazol-1-yl)-4-methyl-2-oxoquinolin-1(2H)-yl)ethyl)piperidin-4-yl)carbamate

Product 2

HCID 313Hydrochloric AcidHCID 59398438HCID 59398438, compound

Sources & evidence

ORD record
ord-dd9e444c5f9340f19b1c631e541aaf70
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (5/10)

Reaction notes

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