Hydrochloric Acid → HCID 86076555, compound

HRID 104280

Reaction equation

HRID 104280 reaction equation
[CH3:2][N:3]([CH3:4])[CH2:5][CH2:6][CH2:7][N:8]=[C:9]=[N:10][CH2:11][CH3:12].[CH3:40][NH:41][O:42][CH3:43].[CH:13]([N:14]([CH:15]([CH3:16])[CH3:17])[CH2:18][CH3:19])([CH3:20])[CH3:21].[ClH:1].[ClH:39].[O:44]1[CH2:45][CH2:46][CH2:47][CH2:48]1.[c:22]1([C:28]#[C:29][c:30]2[cH:31][n:32][cH:33][c:34]([C:35](=[O:36])[OH:37])[cH:38]2)[cH:23][cH:24][cH:25][cH:26][cH:27]1>>[c:22]1([C:28]#[C:29][c:30]2[cH:31][n:32][cH:33][c:34]([C:35](=[O:36])[N:41]([CH3:40])[O:42][CH3:43])[cH:38]2)[cH:23][cH:24][cH:25][cH:26][cH:27]1

Participants

7

Reactant 6

HCID 313Hydrochloric Acid2×HCID 8028TetrahydrofuranHCID 14232N,O-DimethylhydroxylamineHCID 159081-Ethyl-3-(3'-dimethylaminopropyl)carbodiimideHCID 81531DiisopropylethylamineHCID 27792365-(2-Phenyleth-1-Ynyl)Nicotinic Acid

Product 1

HCID 86076555HCID 86076555, compound

Sources & evidence

ORD record
ord-4a73c060a8924f54802e4797ec9989f3
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (2/10)

Linked notes

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