Hydrochloric Acid → 5-(3-Phenyloxypropyl) 3-(2-cyanoethyl) 4-(3-chlorophenyl)-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylate

HRID 183789

Reaction equation

HRID 183789 reaction equation
[CH3:38][N:39]([CH3:40])[CH2:41][CH2:42][CH2:43][N:44]=[C:45]=[N:46][CH2:47][CH3:48].[CH3:50][N:51]([CH3:52])[c:53]1[cH:54][cH:55][n:56][cH:57][cH:58]1.[Cl:1][c:2]1[cH:3][c:4]([CH:8]2[C:9]([C:19](=[O:20])[O:21][CH2:22][CH2:23][C:24]#[N:25])=[C:10]([CH3:18])[NH:11][C:12]([CH3:17])=[C:13]2[C:14](=[O:15])[O-:16])[cH:5][cH:6][cH:7]1.[Cl:59][CH2:60][Cl:61].[ClH:37].[OH2:49].[c:26]1([O:32][CH2:33][CH2:34][CH2:35][OH:36])[cH:27][cH:28][cH:29][cH:30][cH:31]1>>[Cl:1][c:2]1[cH:3][c:4]([CH:8]2[C:9]([C:19](=[O:20])[O:21][CH2:22][CH2:23][C:24]#[N:25])=[C:10]([CH3:18])[NH:11][C:12]([CH3:17])=[C:13]2[C:14](=[O:15])[O:16][CH2:35][CH2:34][CH2:33][O:32][c:26]2[cH:27][cH:28][cH:29][cH:30][cH:31]2)[cH:5][cH:6][cH:7]1

Participants

8

Reactant 7

HCID 313Hydrochloric AcidHCID 962WaterHCID 6344DichloromethaneHCID 142844-(Dimethylamino)pyridineHCID 159081-Ethyl-3-(3'-dimethylaminopropyl)carbodiimideHCID 803193-Phenoxy 1-propanolHCID 86757801Mono(2-cyanoethyl) 4-(3-chlorophenyl)-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylate

Product 1

HCID 695906375-(3-Phenyloxypropyl) 3-(2-cyanoethyl) 4-(3-chlorophenyl)-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylate

Sources & evidence

ORD record
ord-3f1e4d32f8394b8a9798b92bf5358aa3
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (6/10)

Linked notes

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