[4-(4-octan-2-yloxycarbonylphenyl)phenyl] 3-fluoranyl-4-(2-octoxypropanoyloxy)benzoate

Systemtic Name: [4-(4-octan-2-yloxycarbonylphenyl)phenyl] 3-fluoranyl-4-(2-octoxypropanoyloxy)benzoate Openeye Name: [4-[4-(1-methylheptoxycarbonyl)phenyl]phenyl] 3-fluoro-4-(2-octoxypropanoyloxy)benzoate CAS Name: 3-fluoro-4-(2-octoxy-1-oxopropoxy)benzoic acid [4-[4-[octan-2-yloxy(oxo)methyl]phenyl]phenyl] ester IUPAC Name: [4-(4-octan-2-yloxycarbonylphenyl)phenyl] 3-fluoro-4-(2-octoxypropanoyloxy)benzoate Traditional Name: 3-fluoro-4-(2-octoxypropanoyloxy)benzoic acid [4-[4-(1-methylheptoxycarbonyl)phenyl]phenyl] ester Formula: C39H49FO7 MolecularWeight: 648.800563

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOC(C)C(=O)OC1=C(C=C(C=C1)C(=O)OC2=CC=C(C=C2)C3=CC=C(C=C3)C(=O)OC(C)CCCCCC)F

Isomeric SMILES

CCCCCCCCOC(C)C(=O)OC1=C(C=C(C=C1)C(=O)OC2=CC=C(C=C2)C3=CC=C(C=C3)C(=O)OC(C)CCCCCC)F

InChI

InChI=1S/C39H49FO7/c1-5-7-9-11-12-14-26-44-29(4)37(41)47-36-25-22-33(27-35(36)40)39(43)46-34-23-20-31(21-24-34)30-16-18-32(19-17-30)38(42)45-28(3)15-13-10-8-6-2/h16-25,27-29H,5-15,26H2,1-4H3