Bicarbonate Ion → ethyl 4-[2-(N-ethoxycarbonyl-N-methylaminomethyl)morpholino]-2,3,5-trifluorobenzoylacetate

HRID 302180

Reaction equation

HRID 302180 reaction equation
[C:33](=[O:34])([O-:35])[OH:36].[CH2:19]([CH3:20])[O:21][C:22](=[O:23])[N:24]([CH3:25])[CH2:26][CH:27]1[O:28][CH2:29][CH2:30][NH:31][CH2:32]1.[CH3:38][C:39]#[N:40].[F:1][c:2]1[c:3]([C:4](=[O:5])[CH2:6][C:7](=[O:8])[O:9][CH2:10][CH3:11])[cH:12][c:13]([F:18])[c:14]([F:17])[c:15]1[F:16].[Na+:37]>>[F:1][c:2]1[c:3]([C:4](=[O:5])[CH2:6][C:7](=[O:8])[O:9][CH2:10][CH3:11])[cH:12][c:13]([F:18])[c:14]([N:31]2[CH2:30][CH2:29][O:28][CH:27]([CH2:26][N:24]([C:22]([O:21][CH2:19][CH3:20])=[O:23])[CH3:25])[CH2:32]2)[c:15]1[F:16]

Participants

6

Reactant 5

HCID 769Bicarbonate IonHCID 923Sodium ionHCID 6342AcetonitrileHCID 600916Ethyl 3-oxo-(2,3,4,5-tetrafluorophenyl)propanoateHCID 146525772-(N-ethoxycarbonyl-N-methylaminomethyl)morpholine

Product 1

HCID 14652581ethyl 4-[2-(N-ethoxycarbonyl-N-methylaminomethyl)morpholino]-2,3,5-trifluorobenzoylacetate

Sources & evidence

ORD record
ord-f1838a93498c41259ec4ea578a1184c0
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (8/10)

Linked notes

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