Ethyl Acetate → Jjy8ryh7J4

HRID 301250Notes

Reaction equation

HRID 301250 reaction equation
[C:45]([O:46][CH3:47])([CH3:48])([CH3:49])[CH3:50].[CH3:39][CH2:40][O:41][C:42]([CH3:43])=[O:44].[Cl:30][c:31]1[cH:32][cH:33][c:34]([CH2:35][NH2:36])[cH:37][cH:38]1.[O:1]1[CH2:2][CH2:3][N:4]([n:7]2[cH:8][c:9]([C:25]([O:27][CH2:26][CH3:28])=[O:29])[c:10](=[O:24])[c:11]3[cH:12][c:13]([CH2:17][N:18]4[CH2:19][CH2:20][O:21][CH2:22][CH2:23]4)[cH:14][cH:15][c:16]23)[CH2:5][CH2:6]1>>[O:1]1[CH2:2][CH2:3][N:4]([n:7]2[cH:8][c:9]([C:25](=[O:27])[NH:36][CH2:35][c:34]3[cH:33][cH:32][c:31]([Cl:30])[cH:38][cH:37]3)[c:10](=[O:24])[c:11]3[cH:12][c:13]([CH2:17][N:18]4[CH2:19][CH2:20][O:21][CH2:22][CH2:23]4)[cH:14][cH:15][c:16]23)[CH2:5][CH2:6]1

Participants

5

Reactant 4

HCID 8857Ethyl AcetateHCID 15413tert-Butyl methyl etherHCID 660364-ChlorobenzylamineHCID 21192510Ethyl 1-(4-morpholinyl)-6-(4-morpholinylmethyl)-4-oxo-1,4-dihydro-3-quinolinecarboxylate

Product 1

HCID 490487Jjy8ryh7J4

Sources & evidence

ORD record
ord-8106acd06cb14b098ed0b2416f318f17
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (8/10)

Reaction notes

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