Dichloromethane → ethyl 5-(4,5-dimethoxy-2-nitrobenzoyl)-2-(3-methoxypentan-3-yl)-2H-1,2,3-triazole-4-carboxylate

HRID 281756Notes

Reaction equation

HRID 281756 reaction equation
[CH2:46]([Cl:47])[Cl:48].[CH3:14][O:15][c:16]1[cH:17][c:18]([N+:36](=[O:37])[O-:38])[c:19]([C:20](=[O:21])[c:22]2[c:23]([C:27](=[O:28])[O:29][CH2:30][CH3:31])[n:24][n:25][nH:26]2)[cH:32][c:33]1[O:34][CH3:35].[CH3:1][CH2:2][C:3]([CH2:4][CH3:5])=[O:6].[CH3:39][CH2:40][N:41]([CH2:42][CH3:43])[CH2:44][CH3:45].[CH3:7][O:8][CH:9]([O:10][CH3:11])[O:12][CH3:13]>>[CH3:1][CH2:2][C:3]([CH2:4][CH3:5])([O:6][CH3:7])[n:25]1[n:24][c:23]([C:27](=[O:28])[O:29][CH2:30][CH3:31])[c:22]([C:20]([c:19]2[c:18]([N+:36](=[O:37])[O-:38])[cH:17][c:16]([O:15][CH3:14])[c:33]([O:34][CH3:35])[cH:32]2)=[O:21])[n:26]1

Participants

6

Reactant 5

HCID 6344DichloromethaneHCID 7288Ethyl ketoneHCID 8471TriethylamineHCID 9005Trimethyl orthoformateHCID 178470514HCID 178470514, compound

Product 1

HCID 22222604ethyl 5-(4,5-dimethoxy-2-nitrobenzoyl)-2-(3-methoxypentan-3-yl)-2H-1,2,3-triazole-4-carboxylate

Sources & evidence

ORD record
ord-87947f9bdc984ebeb5160e4a009b80fc
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (8/10)

Reaction notes

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