Water → HCID 57460685, compound

HRID 295456Notes

Reaction equation

HRID 295456 reaction equation
[Br:34][C:35]([C:36](=[O:37])[O:38][CH3:39])([CH3:40])[CH3:41].[C:42](=[O:43])([O-:44])[O-:45].[CH3:48][CH2:49][O:50][C:51](=[O:52])[CH3:53].[CH3:54][N:55]([CH3:56])[CH:57]=[O:58].[Cs+:46].[Cs+:47].[OH2:59].[OH:1][c:2]1[cH:3][cH:4][c:5](-[n:8]2[c:9]([CH3:33])[n:10][c:11]([CH2:30][CH2:31][CH3:32])[c:12]([CH2:15][c:16]3[cH:17][cH:18][c:19](-[c:22]4[c:23]([C:28]#[N:29])[cH:24][cH:25][cH:26][cH:27]4)[cH:20][cH:21]3)[c:13]2=[O:14])[cH:6][cH:7]1>>[O:1]([c:2]1[cH:3][cH:4][c:5](-[n:8]2[c:9]([CH3:33])[n:10][c:11]([CH2:30][CH2:31][CH3:32])[c:12]([CH2:15][c:16]3[cH:17][cH:18][c:19](-[c:22]4[c:23]([C:28]#[N:29])[cH:24][cH:25][cH:26][cH:27]4)[cH:20][cH:21]3)[c:13]2=[O:14])[cH:6][cH:7]1)[C:35]([C:36](=[O:37])[O:38][CH3:39])([CH3:40])[CH3:41]

Participants

8

Reactant 7

HCID 962WaterHCID 6228DimethylformamideHCID 8857Ethyl AcetateHCID 19660Carbonate IonHCID 90097Methyl 2-bromo-2-methylpropionateHCID 104967Cesium cation2×HCID 57460377HCID 57460377, compound

Product 1

HCID 57460685HCID 57460685, compound

Sources & evidence

ORD record
ord-04267d44a5c9400e88ac2a01955017f2
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (8/10)

Reaction notes

Loading…