2-[5-(4-fluorophenoxy)-4'-(trifluoromethyl)biphenyl-3-yl]pentanoic acid

Properties Image MNX_ID MNXM34769 reference chebi:48658 formula C24H20F4O3 global charge 0 mol weight 432.413 InChIKey KAWUMBNUWGJBOH-UHFFFAOYSA-N InChI InChI=1S/C24H20F4O3/c1-2-3-22(23(29)30)17-12-16(15-4-6-18(7-5-15)24(26,27)28)13-21(14-17)31-20-10-8-19(25)9-11-20/h4-14,22H,2-3H2,1H3,(H,29,30) SMILES CCCC(C(=O)O)C1=CC(C2=CC=C(C(F)(F)F)C=C2)=CC(OC2=CC=C(F)C=C2)=C1 MNX internals InChI (mnx) InChI=1/C24H20F4O3/c1-2-3-22(23(29)30)17-12-16(15-4-6-18(7-5-15)24(26,27)28)13-21(14-17)31-20-10-8-19(25)9-11-20/h4-14,22H,2-3H2,1H3,(H,29,30)/t22? SMILES (mnx) [CH3:1][CH2:2][CH2:3][CH:22]([C:17]1=[CH:14][C:21]([O:31][C:20]2=[CH:11][CH:9]=[C:19]([F:25])[CH:8]=[CH:10]2)=[CH:13][C:16]([C:15]2=[CH:5][CH:7]=[C:18]([C:24]([F:26])([F:27])[F:28])[CH:6]=[CH:4]2)=[CH:12]1)[C:23](=[O:29])[OH:30]

Parent-child relations graph

Occurences in reactions #reac in my sandbox 0 in MNXref (generic) 0 in models (compartimentalized) 0