3-[5-chloranyl-2-[(E)-3-[4-(trifluoromethyl)phenyl]prop-2-enoxy]phenoxy]benzoic acid

Systemtic Name: 3-[5-chloranyl-2-[(E)-3-[4-(trifluoromethyl)phenyl]prop-2-enoxy]phenoxy]benzoic acid Openeye Name: 3-[5-chloro-2-[(E)-3-[4-(trifluoromethyl)phenyl]allyloxy]phenoxy]benzoic acid CAS Name: 3-[5-chloro-2-[(E)-3-[4-(trifluoromethyl)phenyl]prop-2-enoxy]phenoxy]benzoic acid IUPAC Name: 3-[5-chloro-2-[(E)-3-[4-(trifluoromethyl)phenyl]prop-2-enoxy]phenoxy]benzoic acid Traditional Name: 3-[5-chloro-2-[(E)-3-[4-(trifluoromethyl)phenyl]allyloxy]phenoxy]benzoic acid Formula: C23H16ClF3O4 MolecularWeight: 448.81895

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)OC2=C(C=CC(=C2)Cl)OCC=CC3=CC=C(C=C3)C(F)(F)F)C(=O)O

Isomeric SMILES

C1=CC(=CC(=C1)OC2=C(C=CC(=C2)Cl)OC/C=C/C3=CC=C(C=C3)C(F)(F)F)C(=O)O

InChI

InChI=1S/C23H16ClF3O4/c24-18-10-11-20(21(14-18)31-19-5-1-4-16(13-19)22(28)29)30-12-2-3-15-6-8-17(9-7-15)23(25,26)27/h1-11,13-14H,12H2,(H,28,29)/b3-2+