(4-decoxyphenyl) 4-(4-decoxy-3-fluoranyl-phenyl)-2,3-bis(fluoranyl)benzoate

Systemtic Name: (4-decoxyphenyl) 4-(4-decoxy-3-fluoranyl-phenyl)-2,3-bis(fluoranyl)benzoate Openeye Name: (4-decoxyphenyl) 4-(4-decoxy-3-fluoro-phenyl)-2,3-difluoro-benzoate CAS Name: 4-(4-decoxy-3-fluorophenyl)-2,3-difluorobenzoic acid (4-decoxyphenyl) ester IUPAC Name: (4-decoxyphenyl) 4-(4-decoxy-3-fluorophenyl)-2,3-difluorobenzoate Traditional Name: 4-(4-decoxy-3-fluoro-phenyl)-2,3-difluoro-benzoic acid (4-decoxyphenyl) ester Formula: C39H51F3O4 MolecularWeight: 640.81505

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCOC1=CC=C(C=C1)OC(=O)C2=C(C(=C(C=C2)C3=CC(=C(C=C3)OCCCCCCCCCC)F)F)F

Isomeric SMILES

CCCCCCCCCCOC1=CC=C(C=C1)OC(=O)C2=C(C(=C(C=C2)C3=CC(=C(C=C3)OCCCCCCCCCC)F)F)F

InChI

InChI=1S/C39H51F3O4/c1-3-5-7-9-11-13-15-17-27-44-31-20-22-32(23-21-31)46-39(43)34-25-24-33(37(41)38(34)42)30-19-26-36(35(40)29-30)45-28-18-16-14-12-10-8-6-4-2/h19-26,29H,3-18,27-28H2,1-2H3