Catalog Number:
AG01DGL2
Chemical Name:
4-((1-carboxypentyl)oxy)-2-hydroxy-5-((2-(trifluoromethoxy)phenyl)ethynyl)benzoic acid
CAS Number:
1772609-48-9
Molecular Formula:
C22H19F3O7
Molecular Weight:
452.3773
IUPAC Name:
4-(1-carboxypentoxy)-2-hydroxy-5-[2-[2-(trifluoromethoxy)phenyl]ethynyl]benzoic acid
InChI:
InChI=1S/C22H19F3O7/c1-2-3-7-18(21(29)30)31-19-12-16(26)15(20(27)28)11-14(19)10-9-13-6-4-5-8-17(13)32-22(23,24)25/h4-6,8,11-12,18,26H,2-3,7H2,1H3,(H,27,28)(H,29,30)
InChI Key:
HBPHMRPDLSINHQ-UHFFFAOYSA-N
SMILES:
CCCCC(C(=O)O)Oc1cc(O)c(cc1C#Cc1ccccc1OC(F)(F)F)C(=O)O
