3-[4-[3-(4-chloranyl-2-phenoxy-phenoxy)phenoxy]-2-fluoranyl-phenyl]propanoic acid

Systemtic Name: 3-[4-[3-(4-chloranyl-2-phenoxy-phenoxy)phenoxy]-2-fluoranyl-phenyl]propanoic acid Openeye Name: 3-[4-[3-(4-chloro-2-phenoxy-phenoxy)phenoxy]-2-fluoro-phenyl]propanoic acid CAS Name: 3-[4-[3-(4-chloro-2-phenoxyphenoxy)phenoxy]-2-fluorophenyl]propanoic acid IUPAC Name: 3-[4-[3-(4-chloro-2-phenoxyphenoxy)phenoxy]-2-fluorophenyl]propanoic acid Traditional Name: 3-[4-[3-(4-chloro-2-phenoxy-phenoxy)phenoxy]-2-fluoro-phenyl]propionic acid Formula: C27H20ClFO5 MolecularWeight: 478.896103

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)OC2=C(C=CC(=C2)Cl)OC3=CC=CC(=C3)OC4=CC(=C(C=C4)CCC(=O)O)F

Isomeric SMILES

C1=CC=C(C=C1)OC2=C(C=CC(=C2)Cl)OC3=CC=CC(=C3)OC4=CC(=C(C=C4)CCC(=O)O)F

InChI

InChI=1S/C27H20ClFO5/c28-19-11-13-25(26(15-19)33-20-5-2-1-3-6-20)34-22-8-4-7-21(16-22)32-23-12-9-18(24(29)17-23)10-14-27(30)31/h1-9,11-13,15-17H,10,14H2,(H,30,31)