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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCOC1=C(C=C(C=C1)C2=CC=C(C=C2)C(=O)OC3=C(C(=C(C=C3)OCCCCCCCCCC)F)F)F

Isomeric SMILES

CCCCCCCCCCOC1=C(C=C(C=C1)C2=CC=C(C=C2)C(=O)OC3=C(C(=C(C=C3)OCCCCCCCCCC)F)F)F

InChI

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