Ethanol → 3-[2-(4-tert-Butyl-phenyl)-ethylamino]-4-(4-methoxy-phenyl)-cyclobut-3-ene-1,2-dione

HRID 158751

Reaction equation

HRID 158751 reaction equation
[C:19]([CH3:20])([CH3:21])([CH3:22])[c:23]1[cH:24][cH:25][c:26]([CH2:27][CH2:28][NH2:29])[cH:30][cH:31]1.[CH3:32][CH2:33][OH:34].[CH:1]([O:2][c:5]1[c:6](=[O:18])[c:7](=[O:17])[c:8]1-[c:9]1[cH:10][cH:11][c:12]([O:15][CH3:16])[cH:13][cH:14]1)([CH3:3])[CH3:4]>>[c:5]1([NH:29][CH2:28][CH2:27][c:26]2[cH:25][cH:24][c:23]([C:19]([CH3:20])([CH3:21])[CH3:22])[cH:31][cH:30]2)[c:6](=[O:18])[c:7](=[O:17])[c:8]1-[c:9]1[cH:10][cH:11][c:12]([O:15][CH3:16])[cH:13][cH:14]1

Participants

4

Reactant 3

HCID 702EthanolHCID 27356892-(4-Tert-butylphenyl)ethan-1-amineHCID 147378433-Isopropoxy-4-(4-methoxy-phenyl)-cyclobut-3-ene-1,2-dione

Product 1

HCID 99070453-[2-(4-tert-Butyl-phenyl)-ethylamino]-4-(4-methoxy-phenyl)-cyclobut-3-ene-1,2-dione

Sources & evidence

ORD record
ord-e6a5eaef27b746829bb5f2a0a32ea42d
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (9/10)

Linked notes

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