Hydrochloric Acid → Hydrochloric Acid

HRID 144154Notes

Reaction equation

HRID 144154 reaction equation
[C:3]([O:4][C:5](=[O:6])[N:9]([CH:10]1[CH2:11][CH2:12][N:13]([CH2:16][CH2:17][n:18]2[c:19](=[O:29])[cH:20][cH:21][c:22]3[cH:23][cH:24][c:25]([CH3:28])[cH:26][c:27]23)[CH2:14][CH2:15]1)[CH2:30][c:31]1[cH:32][c:33]2[c:34]([cH:39][cH:40]1)[O:35][CH2:36][CH2:37][O:38]2)([CH3:7])([CH3:8])[CH3:41].[C:42]([O:43][CH2:44][CH3:45])(=[O:46])[CH3:47].[CH3:1][OH:2].[CH3:49][CH2:50][O:51][C:52](=[O:53])[CH3:54].[ClH:48]>>[ClH:48].[NH:9]([CH:10]1[CH2:11][CH2:12][N:13]([CH2:16][CH2:17][n:18]2[c:19](=[O:29])[cH:20][cH:21][c:22]3[cH:23][cH:24][c:25]([CH3:28])[cH:26][c:27]23)[CH2:14][CH2:15]1)[CH2:30][c:31]1[cH:32][c:33]2[c:34]([cH:39][cH:40]1)[O:35][CH2:36][CH2:37][O:38]2

Participants

6

Reactant 4

HCID 313Hydrochloric AcidHCID 887MethanolHCID 8857Ethyl Acetate2×HCID 59398272tert-butyl (2,3-dihydro-1,4-benzodioxin-6-ylmethyl)(1-(2-(7-methyl-2-oxoquinolin-1(2H)-yl)ethyl)piperidin-4-yl)carbamate

Product 2

HCID 313Hydrochloric AcidHCID 593978781-[2-[4-(2,3-Dihydro-1,4-benzodioxin-6-ylmethylamino)piperidin-1-yl]ethyl]-7-methylquinolin-2-one

Sources & evidence

ORD record
ord-483dc708bfb64469a253c4bef093f944
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (9/10)

Reaction notes

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