Acetone → HCID 59397872, compound

HRID 91120Notes

Reaction equation

HRID 91120 reaction equation
[C:5]([CH3:6])([CH3:7])([CH3:8])[O:9][C:10](=[O:11])[N:12]([CH:13]1[CH2:14][CH2:15][N:16]([CH2:19][CH2:20][n:21]2[c:22](=[O:35])[cH:23][c:24]([C:31](=[O:32])[O:33][CH3:34])[c:25]3[cH:26][cH:27][cH:28][cH:29][c:30]23)[CH2:17][CH2:18]1)[CH2:36][c:37]1[cH:38][c:39]2[c:40]([cH:45][cH:46]1)[O:41][CH2:42][CH2:43][O:44]2.[CH3:1][C:2](=[O:3])[CH3:4].[Na+:48].[OH-:47].[OH2:49]>>[C:5]([CH3:6])([CH3:7])([CH3:8])[O:9][C:10](=[O:11])[N:12]([CH:13]1[CH2:14][CH2:15][N:16]([CH2:19][CH2:20][n:21]2[c:22](=[O:35])[cH:23][c:24]([C:31](=[O:32])[OH:33])[c:25]3[cH:26][cH:27][cH:28][cH:29][c:30]23)[CH2:17][CH2:18]1)[CH2:36][c:37]1[cH:38][c:39]2[c:40]([cH:45][cH:46]1)[O:41][CH2:42][CH2:43][O:44]2

Participants

6

Reactant 5

HCID 180AcetoneHCID 923Sodium ionHCID 961HydroxideHCID 962WaterHCID 59397905tert-butyl (2,3-dihydro-1,4-benzodioxin-6-ylmethyl)(1-(2-(4-methoxycarbonyl-2-oxoquinolin-1(2H)-yl)ethyl)piperidin-4-yl)carbamate

Product 1

HCID 59397872HCID 59397872, compound

Sources & evidence

ORD record
ord-2edd834f05674f32b6348473ab3923c0
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (2/10)

Reaction notes

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