Dichloromethane → 2,6-Dimethyl-3-methoxycarbonyl-4-(3-nitrophenyl)-5-(2-[4-(2,2-dimethyl-1,3-dioxolan-4-yl)methoxyphenyl]ethoxycarbonyl)-1,4-dihydropyridine

HRID 670111Notes

Reaction equation

HRID 670111 reaction equation
[CH3:1][C:2]1=[C:7]([C:8](=[O:9])[O:10][CH3:11])[CH:6]([c:12]2[cH:13][c:14]([N+:18](=[O:19])[O-:20])[cH:15][cH:16][cH:17]2)[C:5]([C:21](=[O:22])[OH:23])=[C:4]([CH3:24])[NH:3]1.[CH3:25][C:26]1([CH3:42])[O:27][CH2:28][CH:29]([CH2:31][O:32][c:33]2[cH:34][cH:35][c:36]([CH2:39][CH2:40][OH:41])[cH:37][cH:38]2)[O:30]1.[CH3:43][CH2:44][N:45]([CH2:46][CH3:47])[CH2:48][CH3:49].[Cl:50][CH2:51][Cl:52]>>[CH3:1][C:2]1=[C:7]([C:8](=[O:9])[O:10][CH3:11])[CH:6]([c:12]2[cH:13][c:14]([N+:18](=[O:19])[O-:20])[cH:15][cH:16][cH:17]2)[C:5]([C:21](=[O:22])[O:41][CH2:40][CH2:39][c:36]2[cH:35][cH:34][c:33]([O:32][CH2:31][CH:29]3[CH2:28][O:27][C:26]([CH3:25])([CH3:42])[O:30]3)[cH:38][cH:37]2)=[C:4]([CH3:24])[NH:3]1

Participants

5

Reactant 4

HCID 6344DichloromethaneHCID 8471TriethylamineHCID 1733222,6-Dimethyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylic acid monomethyl esterHCID 139239034-(2,2-Dimethyl-1,3-dioxolan-4-yl)methoxyphenylethan-2-ol

Product 1

HCID 136325642,6-Dimethyl-3-methoxycarbonyl-4-(3-nitrophenyl)-5-(2-[4-(2,2-dimethyl-1,3-dioxolan-4-yl)methoxyphenyl]ethoxycarbonyl)-1,4-dihydropyridine

Sources & evidence

ORD record
ord-1b5ea97513774e80a7e0edd6a09cd092
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Reaction notes

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