3-fluoranyl-4-[4-oxidanylidene-2-(4-oxidanyl-3-propyl-phenoxy)pentoxy]benzoic acid

Systemtic Name: 3-fluoranyl-4-[4-oxidanylidene-2-(4-oxidanyl-3-propyl-phenoxy)pentoxy]benzoic acid Openeye Name: 3-fluoro-4-[2-(4-hydroxy-3-propyl-phenoxy)-4-oxo-pentoxy]benzoic acid CAS Name: 3-fluoro-4-[2-(4-hydroxy-3-propylphenoxy)-4-oxopentoxy]benzoic acid IUPAC Name: 3-fluoro-4-[2-(4-hydroxy-3-propylphenoxy)-4-oxopentoxy]benzoic acid Traditional Name: 3-fluoro-4-[2-(4-hydroxy-3-propyl-phenoxy)-4-keto-pentoxy]benzoic acid Formula: C21H23FO6 MolecularWeight: 390.402123

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C=CC(=C1)OC(CC(=O)C)COC2=C(C=C(C=C2)C(=O)O)F)O

Isomeric SMILES

CCCC1=C(C=CC(=C1)OC(CC(=O)C)COC2=C(C=C(C=C2)C(=O)O)F)O

InChI

InChI=1S/C21H23FO6/c1-3-4-14-10-16(6-7-19(14)24)28-17(9-13(2)23)12-27-20-8-5-15(21(25)26)11-18(20)22/h5-8,10-11,17,24H,3-4,9,12H2,1-2H3,(H,25,26)