Methanol → HCID 44547649, compound

HRID 684184Notes

Reaction equation

HRID 684184 reaction equation
[C:25](=[O:26])([O-:27])[O-:28].[CH2:83]1[O:84][CH2:85][CH2:86][CH2:87]1.[CH3:1][O:2][C:3]([c:4]1[c:5]([CH3:6])[cH:7][c:8](-[c:9]2[cH:10][cH:11][cH:12][c:13]([C:14]([F:15])([F:16])[F:17])[cH:18]2)[c:19]([OH:20])[n:21]1)=[O:22].[CH3:23][I:24].[CH3:31][O:32][C:33](=[O:34])[c:35]1[n:36]([CH3:53])[c:37](=[O:52])[c:38](-[c:42]2[cH:43][c:44]([C:48]([F:49])([F:50])[F:51])[cH:45][cH:46][cH:47]2)[cH:39][c:40]1[CH3:41].[CH3:88][OH:89].[Cl:56][C:57]([C:58]([Cl:59])=[O:60])=[O:61].[Cl:90][CH2:91][Cl:92].[Cs+:29].[Cs+:30].[Li+:54].[N:67]1([CH:72]2[CH2:73][CH2:74][NH:75][CH2:76][CH2:77]2)[CH2:68][CH2:69][CH2:70][CH2:71]1.[O:62]=[CH:63][N:64]([CH3:65])[CH3:66].[O:78]=[CH:79][N:80]([CH3:81])[CH3:82].[OH-:55]>>[C:33](=[O:34])([c:35]1[n:36]([CH3:53])[c:37](=[O:52])[c:38](-[c:42]2[cH:43][c:44]([C:48]([F:49])([F:50])[F:51])[cH:45][cH:46][cH:47]2)[cH:39][c:40]1[CH3:41])[N:75]1[CH2:74][CH2:73][CH:72]([N:67]2[CH2:68][CH2:69][CH2:70][CH2:71]2)[CH2:77][CH2:76]1

Participants

14

Reactant 13

HCID 887MethanolHCID 961HydroxideHCID 6228Dimethylformamide2×HCID 6328Methyl iodideHCID 6344DichloromethaneHCID 8028TetrahydrofuranHCID 19660Carbonate IonHCID 28486Lithium ionHCID 65578Oxalyl chlorideHCID 787034-(1-Pyrrolidinyl)piperidineHCID 104967Cesium cation2×HCID 57441172HCID 57441172, compoundHCID 670252896-Hydroxy-3-methyl-5-(3-trifluoromethyl-phenyl)-pyridine-2-carboxylic acid methyl ester

Product 1

HCID 44547649HCID 44547649, compound

Sources & evidence

ORD record
ord-f2c890e081fc4617ac952695c5278101
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Reaction notes

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