HCID 11288995, compound → HCID 57841339, compound

HRID 671660Notes

Reaction equation

HRID 671660 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][c:15]([F:21])[c:16]([CH:17]=[O:18])[cH:19][cH:20]2)[cH:9][cH:10]1.[NH2:22][c:23]1[cH:24][c:25]2[c:26]([cH:34][cH:35]1)[O:27][C:28]([CH3:32])([CH3:33])[O:29][C:30]2=[O:31]>>[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][c:15]([F:21])[c:16]([CH2:17][NH:22][c:23]3[cH:24][c:25]4[c:26]([cH:34][cH:35]3)[O:27][C:28]([CH3:32])([CH3:33])[O:29][C:30]4=[O:31])[cH:19][cH:20]2)[cH:9][cH:10]1

Participants

3

Reactant 2

HCID 11288995HCID 11288995, compoundHCID 116153306-Amino-2,2-dimethyl-benzo[1,3]dioxin-4-one

Product 1

HCID 57841339HCID 57841339, compound

Sources & evidence

ORD record
ord-eb3e9b0088c24d5fb2756ce8d0ac0e68
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Reaction notes

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