Acetate → HCID 56978109, compound

Reaction equation

[CH2:19]([CH3:20])[O:21][C:22](=[O:23])[c:24]1[cH:25][n:26][c:27]2[n:28]([c:29]1=[O:30])[CH:31]([CH3:35])[CH2:32][CH2:33][CH2:34]2.[CH3:15][C:16](=[O:17])[O-:18].[Cl:1][c:2]1[cH:3][cH:4][c:5]([NH2:6])[cH:7][cH:8]1.[ClH:9].[N:10]([O-:11])=[O:12].[Na+:13].[Na+:14].[OH2:36]>>[Cl:1][c:2]1[cH:3][cH:4][c:5]([NH:6][N:10]=[C:34]2[c:27]3[n:26][cH:25][c:24]([C:22]([O:21][CH2:19][CH3:20])=[O:23])[c:29](=[O:30])[n:28]3[CH:31]([CH3:35])[CH2:32][CH2:33]2)[cH:7][cH:8]1

Participants

Reactant 7

HCID 175Acetate

HCID 313Hydrochloric Acid

HCID 923Sodium Ion2×

HCID 946Nitrite

HCID 962Water

HCID 78124-Chloroaniline

HCID 208414Ethyl 6-methyl-4-oxo-6,7,8,9-tetrahydro-4H-pyrido[1,2-a]pyrimidine-3-carboxylate

Product 1

Sources & evidence

ORD record: ord-9e69f403d3a44bafa96dd6753bad8797
Source dataset: Training data from https://doi.org/10.1039/C8SC04228D (1/10)
DOI: 10.1039/C8SC04228D

Reaction notes

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