[5-fluoro-1-(4-isopropylbenzylidene)-2-methylinden-3-yl]acetic acid

Properties Image MNX_ID MNXM39758 reference chebi:59660 formula C22H21FO2 global charge 0 mol weight 336.406 InChIKey QCXBVGNDRYQVJO-GRSHGNNSSA-N InChI InChI=1S/C22H21FO2/c1-13(2)16-6-4-15(5-7-16)10-19-14(3)20(12-22(24)25)21-11-17(23)8-9-18(19)21/h4-11,13H,12H2,1-3H3,(H,24,25)/b19-10- SMILES CC1=C(CC(=O)O)C2=C(C=CC(F)=C2)/C1=C\C1=CC=C(C(C)C)C=C1 MNX internals InChI (mnx) InChI=1/C22H21FO2/c1-13(2)16-6-4-15(5-7-16)10-19-14(3)20(12-22(24)25)21-11-17(23)8-9-18(19)21/h4-11,13H,12H2,1-3H3,(H,24,25)/b19-10- SMILES (mnx) [CH3:1][CH:13]([CH3:2])[C:16]1=[CH:7][CH:5]=[C:15](/[CH:10]=[C:19]2/[C:14]([CH3:3])=[C:20]([CH2:12][C:22](=[O:24])[OH:25])[C:21]3=[C:18]2[CH:9]=[CH:8][C:17]([F:23])=[CH:11]3)[CH:4]=[CH:6]1

Parent-child relations graph

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