(4-octan-2-yloxycarbonylphenyl) 3-fluoranyl-4-hexanoyloxy-benzoate

Systemtic Name: (4-octan-2-yloxycarbonylphenyl) 3-fluoranyl-4-hexanoyloxy-benzoate Openeye Name: [4-(1-methylheptoxycarbonyl)phenyl] 3-fluoro-4-hexanoyloxy-benzoate CAS Name: 3-fluoro-4-(1-oxohexoxy)benzoic acid [4-[octan-2-yloxy(oxo)methyl]phenyl] ester IUPAC Name: (4-octan-2-yloxycarbonylphenyl) 3-fluoro-4-hexanoyloxybenzoate Traditional Name: 4-caproyloxy-3-fluoro-benzoic acid [4-(1-methylheptoxycarbonyl)phenyl] ester Formula: C28H35FO6 MolecularWeight: 486.572303

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(C)OC(=O)C1=CC=C(C=C1)OC(=O)C2=CC(=C(C=C2)OC(=O)CCCCC)F

Isomeric SMILES

CCCCCCC(C)OC(=O)C1=CC=C(C=C1)OC(=O)C2=CC(=C(C=C2)OC(=O)CCCCC)F

InChI

InChI=1S/C28H35FO6/c1-4-6-8-10-11-20(3)33-27(31)21-13-16-23(17-14-21)34-28(32)22-15-18-25(24(29)19-22)35-26(30)12-9-7-5-2/h13-20H,4-12H2,1-3H3