4-[({4-[4-Cyclopropyl-2-(2-trifluoromethoxy-phenyl)-2H-pyrazol-3-ylmethoxy]-2-methyl-phenyl}-methyl-amino)-methyl]-2-methoxy-benzoic Acid → 4-[({4-[4-Cyclopropyl-2-(2-trifluoromethoxy-phenyl)-2H-pyrazol-3-ylmethoxy]-2-methyl-phenyl}-methyl-amino)-methyl]-2-isopropoxy-benzoic Acid

HRID 701217Notes

Reaction equation

HRID 701217 reaction equation
[CH3:43][O:44][C:45]([c:46]1[c:47]([O:83][CH:84]([CH3:85])[CH3:86])[cH:48][c:49]([CH2:52][N:53]([CH3:54])[c:55]2[c:56]([CH3:82])[cH:57][c:58]([O:61][CH2:62][c:63]3[n:64](-[c:71]4[c:72]([O:77][C:78]([F:79])([F:80])[F:81])[cH:73][cH:74][cH:75][cH:76]4)[n:65][cH:66][c:67]3[CH:68]3[CH2:69][CH2:70]3)[cH:59][cH:60]2)[cH:50][cH:51]1)=[O:87].[CH:1]1([c:2]2[cH:3][n:4][n:5](-[c:6]3[cH:7][cH:8][cH:9][cH:10][c:11]3[O:12][C:13]([F:14])([F:15])[F:16])[c:17]2[CH2:18][O:19][c:20]2[cH:21][cH:22][c:23]([N:24]([CH2:25][c:26]3[cH:27][cH:28][c:29]([C:30]([OH:31])=[O:32])[c:33]([O:34][CH3:35])[cH:36]3)[CH3:37])[c:38]([CH3:39])[cH:40]2)[CH2:41][CH2:42]1>>[O:44]=[C:45]([c:46]1[c:47]([O:83][CH:84]([CH3:85])[CH3:86])[cH:48][c:49]([CH2:52][N:53]([CH3:54])[c:55]2[c:56]([CH3:82])[cH:57][c:58]([O:61][CH2:62][c:63]3[n:64](-[c:71]4[c:72]([O:77][C:78]([F:79])([F:80])[F:81])[cH:73][cH:74][cH:75][cH:76]4)[n:65][cH:66][c:67]3[CH:68]3[CH2:69][CH2:70]3)[cH:59][cH:60]2)[cH:50][cH:51]1)[OH:87]

Participants

3

Reactant 2

HCID 579312864-[({4-[4-Cyclopropyl-2-(2-trifluoromethoxy-phenyl)-2H-pyrazol-3-ylmethoxy]-2-methyl-phenyl}-methyl-amino)-methyl]-2-methoxy-benzoic AcidHCID 675281714-[({4-[4-cyclopropyl-2-(2-trifluoromethoxy-phenyl)-2H-pyrazol-3-ylmethoxy]-2-methyl-phenyl}-methyl-amino)-methyl]-2-isopropoxy-benzoic acid methyl ester

Product 1

HCID 579312774-[({4-[4-Cyclopropyl-2-(2-trifluoromethoxy-phenyl)-2H-pyrazol-3-ylmethoxy]-2-methyl-phenyl}-methyl-amino)-methyl]-2-isopropoxy-benzoic Acid

Sources & evidence

ORD record
ord-a25e53d4fe64454eab0c2922b68bd140
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Reaction notes

Loading…