Sodium ion → HCID 178464225, compound

HRID 2338978Notes

Reaction equation

HRID 2338978 reaction equation
[CH3:41][CH2:42][N:43]([CH2:44][CH3:45])[CH2:46][CH3:47].[CH3:59][CH2:60][O:61][C:62](=[O:63])[CH3:64].[Cl:48][CH2:49][C:50](=[O:51])[N:52]([CH2:53][CH3:54])[CH2:55][CH3:56].[I-:58].[Na+:57].[c:1]1([O:7][P:8](=[O:9])([O:10][c:11]2[cH:12][cH:13][cH:14][cH:15][cH:16]2)[CH2:17][NH:18][CH:19]([C:20](=[O:21])[NH:22][CH2:23][CH2:24][C:25](=[O:26])[OH:27])[CH2:28][c:29]2[cH:30][cH:31][c:32](-[c:35]3[cH:36][cH:37][cH:38][cH:39][cH:40]3)[cH:33][cH:34]2)[cH:2][cH:3][cH:4][cH:5][cH:6]1>>[c:1]1([O:7][P:8](=[O:9])([O:10][c:11]2[cH:12][cH:13][cH:14][cH:15][cH:16]2)[CH2:17][NH:18][CH:19]([C:20](=[O:21])[NH:22][CH2:23][CH2:24][C:25](=[O:26])[O:27][CH2:49][C:50](=[O:51])[N:52]([CH2:53][CH3:54])[CH2:55][CH3:56])[CH2:28][c:29]2[cH:30][cH:31][c:32](-[c:35]3[cH:36][cH:37][cH:38][cH:39][cH:40]3)[cH:33][cH:34]2)[cH:2][cH:3][cH:4][cH:5][cH:6]1

Participants

7

Reactant 6

HCID 923Sodium ionHCID 8471TriethylamineHCID 8857Ethyl AcetateHCID 16844Chloro-N,N-diethylacetamideHCID 30165Iodide IonHCID 9893978HCID 9893978, compound

Product 1

HCID 178464225HCID 178464225, compound

Sources & evidence

ORD record
ord-b3f0f1447de8410996058a7ee5eaffa5
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (10/10)

Reaction notes

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