Isoxazole-5-carbonyl chloride → HCID 57841414, compound

HRID 286983Notes

Reaction equation

HRID 286983 reaction equation
[Cl:1][c:2]1[cH:3][cH:4][c:5]([C:8]#[C:9][c:10]2[cH:11][cH:12][c:13]([CH2:14][NH:15][c:16]3[cH:17][c:18]4[c:19]([cH:27][cH:28]3)[O:20][C:21]([CH3:25])([CH3:26])[O:22][C:23]4=[O:24])[cH:29][cH:30]2)[cH:6][cH:7]1.[o:31]1[n:32][cH:33][cH:34][c:35]1[C:36](=[O:37])[Cl:38]>>[Cl:1][c:2]1[cH:3][cH:4][c:5]([C:8]#[C:9][c:10]2[cH:11][cH:12][c:13]([CH2:14][N:15]([c:16]3[cH:17][c:18]4[c:19]([cH:27][cH:28]3)[O:20][C:21]([CH3:25])([CH3:26])[O:22][C:23]4=[O:24])[C:36]([c:35]3[o:31][n:32][cH:33][cH:34]3)=[O:37])[cH:29][cH:30]2)[cH:6][cH:7]1

Participants

3

Reactant 2

HCID 2736707Isoxazole-5-carbonyl chlorideHCID 111543016-({4-[(4-chlorophenyl)ethynyl]benzyl}amino)-2,2-dimethyl-4H-1,3-benzodioxin-4-one

Product 1

HCID 57841414HCID 57841414, compound

Sources & evidence

ORD record
ord-067ac99883e5463b8eb4d57e981a7463
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (8/10)

Reaction notes

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