Sodium ion → HCID 15887920, compound

HRID 167192Notes

Reaction equation

HRID 167192 reaction equation
[Br:38][c:39]1[cH:40][cH:41][c:42]2[c:43](=[O:61])[c:44]([C:56](=[O:57])[O:58][CH2:59][CH3:60])[cH:45][n:46]([CH:53]3[CH2:54][CH2:55]3)[c:47]2[c:48]1[O:49][CH:50]([F:51])[F:52].[CH2:69]([Cl:70])[Cl:71].[CH3:1][CH:2]1[N:3]([C:19]([c:20]2[cH:21][cH:22][cH:23][cH:24][cH:25]2)([c:26]2[cH:27][cH:28][cH:29][cH:30][cH:31]2)[c:32]2[cH:33][cH:34][cH:35][cH:36][cH:37]2)[CH2:4][c:5]2[cH:6][c:7]([B:11]3[O:12][CH2:13][CH2:14][NH:15][CH2:16][CH2:17][O:18]3)[cH:8][cH:9][c:10]21.[CH3:72][CH2:73][O:74][C:75](=[O:76])[CH3:77].[Na+:62].[Na+:63].[O-:64][C:65](=[O:66])[O-:67].[OH2:68]>>[CH3:1][CH:2]1[N:3]([C:19]([c:20]2[cH:21][cH:22][cH:23][cH:24][cH:25]2)([c:26]2[cH:27][cH:28][cH:29][cH:30][cH:31]2)[c:32]2[cH:33][cH:34][cH:35][cH:36][cH:37]2)[CH2:4][c:5]2[cH:6][c:7](-[c:39]3[cH:40][cH:41][c:42]4[c:43](=[O:61])[c:44]([C:56](=[O:57])[O:58][CH2:59][CH3:60])[cH:45][n:46]([CH:53]5[CH2:54][CH2:55]5)[c:47]4[c:48]3[O:49][CH:50]([F:51])[F:52])[cH:8][cH:9][c:10]21

Participants

8

Reactant 7

HCID 923Sodium ion2×HCID 962WaterHCID 6344DichloromethaneHCID 8857Ethyl AcetateHCID 19660Carbonate IonHCID 11732152Ethyl 7-bromo-1-cyclopropyl-8-(difluoromethoxy)-4-oxo-1,4-dihydroquinoline-3-carboxylateHCID 18401784HCID 18401784, compound

Product 1

HCID 15887920HCID 15887920, compound

Sources & evidence

ORD record
ord-14fa85f5736e47f1bf01939bcb83fd4c
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (9/10)

Reaction notes

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