2-Butenedioic acid → (-)-1,4-dihydro-5-isopropoxy-2-methyl-4-(2-trifluoromethylphenyl)-1,6-naphthyridine-3-carboxylic acid [2-(N-methyl-N-phenylmethylamino)ethyl]ester

HRID 2140413

Reaktionsgleichung

Reaktionsgleichung von HRID 2140413
[CH2:35]([c:36]1[cH:37][cH:38][cH:39][cH:40][cH:41]1)[N:42]([CH3:43])[CH2:44][CH2:45][OH:46].[CH2:70]([Cl:71])[Cl:72].[CH3:57][CH2:58][O:59][C:60](=[O:61])[CH3:62].[CH3:73][N:74]([CH3:75])[CH:76]=[O:77].[CH:7]([CH3:8])([CH3:9])[O:10][c:11]1[c:12]2[c:17]([cH:18][cH:19][n:20]1)[NH:16][C:15]([CH3:21])=[C:14]([C:22](=[O:23])[OH:24])[CH:13]2[c:25]1[c:26]([C:31]([F:32])([F:33])[F:34])[cH:27][cH:28][cH:29][cH:30]1.[Cl:1][C:2]([C:3]([Cl:4])=[O:5])=[O:6].[Na+:48].[OH-:47].[OH2:69].[OH:49][C:50]([CH:51]=[CH:52][C:53](=[O:54])[OH:55])=[O:56].[cH:63]1[cH:64][cH:65][n:66][cH:67][cH:68]1>>[CH:7]([CH3:8])([CH3:9])[O:10][c:11]1[c:12]2[c:17]([cH:18][cH:19][n:20]1)[NH:16][C:15]([CH3:21])=[C:14]([C:22]([O:23][CH2:45][CH2:44][N:42]([CH2:35][c:36]1[cH:37][cH:38][cH:39][cH:40][cH:41]1)[CH3:43])=[O:24])[CH:13]2[c:25]1[c:26]([C:31]([F:32])([F:33])[F:34])[cH:27][cH:28][cH:29][cH:30]1

Komponenten

12

Edukt 11

HCID 7232-Butenedioic acidHCID 923Sodium ionHCID 961HydroxideHCID 962WaterHCID 1049PyridineHCID 6228DimethylformamideHCID 6344DichloromethaneHCID 8857Ethyl AcetateHCID 65578Oxalyl chlorideHCID 66876N-Benzyl-N-methylethanolamineHCID 13670941(+)-1,4-Dihydro-5-isopropoxy-2-methyl-4-(2-trifluoromethylphenyl)-1,6-naphthyridine-3-carboxylic acid

Produkt 1

HCID 10256740(-)-1,4-dihydro-5-isopropoxy-2-methyl-4-(2-trifluoromethylphenyl)-1,6-naphthyridine-3-carboxylic acid [2-(N-methyl-N-phenylmethylamino)ethyl]ester

Quellen und Nachweise

ORD-Eintrag
ord-5188cc21df5e47bbbe1c195a7e9f734c
Quelldatensatz
Training data from https://doi.org/10.1039/C8SC04228D (4/10)

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