3-Cyclopentylpropionyl chloride → HCID 57841412, compound

HRID 671951Notes

Reaction equation

HRID 671951 reaction equation
[CH2:1]([CH2:2][CH2:3][CH3:4])[c:5]1[cH:6][cH:7][c:8]([C:11]#[C:12][c:13]2[cH:14][cH:15][c:16]([CH2:17][NH:18][c:19]3[cH:20][c:21]4[c:22]([cH:30][cH:31]3)[O:23][C:24]([CH3:28])([CH3:29])[O:25][C:26]4=[O:27])[cH:32][cH:33]2)[cH:9][cH:10]1.[CH:34]1([CH2:39][CH2:40][C:41](=[O:42])[Cl:43])[CH2:35][CH2:36][CH2:37][CH2:38]1>>[CH2:1]([CH2:2][CH2:3][CH3:4])[c:5]1[cH:6][cH:7][c:8]([C:11]#[C:12][c:13]2[cH:14][cH:15][c:16]([CH2:17][N:18]([c:19]3[cH:20][c:21]4[c:22]([cH:30][cH:31]3)[O:23][C:24]([CH3:28])([CH3:29])[O:25][C:26]4=[O:27])[C:41]([CH2:40][CH2:39][CH:34]3[CH2:35][CH2:36][CH2:37][CH2:38]3)=[O:42])[cH:32][cH:33]2)[cH:9][cH:10]1

Participants

3

Reactant 2

HCID 660393-Cyclopentylpropionyl chlorideHCID 114761686-({4-[(4-butylphenyl)ethynyl]benzyl}amino)-2,2-dimethyl-4H-1,3-benzodioxin-4-one

Product 1

HCID 57841412HCID 57841412, compound

Sources & evidence

ORD record
ord-055d4864c35544189070435fb02206bb
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Reaction notes

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