Chloride → HCID 58406390, compound

HRID 2310318Notes

Reaction equation

HRID 2310318 reaction equation
[C:1]([Cl:2])(=[O:3])[C:4]([Cl:5])=[O:6].[CH3:13][c:14]1[c:15]([C:19](=[O:20])[OH:21])[cH:16][n:17][o:18]1.[Cl-:7].[Cl:22][c:23]1[cH:24][cH:25][c:26]([C:29]23[N:30]([C:31](=[O:44])[c:32]4[n:33]([c:35](-[c:38]5[cH:39][cH:40][n:41][cH:42][cH:43]5)[cH:36][cH:37]4)[CH2:34]2)[CH2:45][CH2:46][NH:47]3)[cH:27][cH:28]1.[Cl:48][CH2:49][Cl:50].[Na+:61].[O-:57][C:58]([OH:59])=[O:60].[O:8]=[CH:9][N:10]([CH3:11])[CH3:12].[cH:51]1[cH:52][cH:53][n:54][cH:55][cH:56]1>>[CH3:13][c:14]1[c:15]([C:19](=[O:21])[N:47]2[C:29]3([c:26]4[cH:25][cH:24][c:23]([Cl:22])[cH:28][cH:27]4)[N:30]([C:31](=[O:44])[c:32]4[n:33]([c:35](-[c:38]5[cH:39][cH:40][n:41][cH:42][cH:43]5)[cH:36][cH:37]4)[CH2:34]3)[CH2:45][CH2:46]2)[cH:16][n:17][o:18]1

Participants

10

Reactant 9

HCID 312ChlorideHCID 769Bicarbonate IonHCID 923Sodium ionHCID 1049PyridineHCID 6228DimethylformamideHCID 6344DichloromethaneHCID 65578Oxalyl chlorideHCID 14252405-Methylisoxazole-4-carboxylic acidHCID 67367651HCID 67367651, compound

Product 1

HCID 58406390HCID 58406390, compound

Sources & evidence

ORD record
ord-d105a3d83a094cdba551d92645087511
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (10/10)

Reaction notes

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