(4-propoxycarbonylphenyl) 4-decanoyloxy-3-fluoranyl-benzoate

Systemtic Name: (4-propoxycarbonylphenyl) 4-decanoyloxy-3-fluoranyl-benzoate Openeye Name: (4-propoxycarbonylphenyl) 4-decanoyloxy-3-fluoro-benzoate CAS Name: 3-fluoro-4-(1-oxodecoxy)benzoic acid [4-[oxo(propoxy)methyl]phenyl] ester IUPAC Name: (4-propoxycarbonylphenyl) 4-decanoyloxy-3-fluorobenzoate Traditional Name: 4-capryloxy-3-fluoro-benzoic acid (4-propoxycarbonylphenyl) ester Formula: C27H33FO6 MolecularWeight: 472.545723

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCC(=O)OC1=C(C=C(C=C1)C(=O)OC2=CC=C(C=C2)C(=O)OCCC)F

Isomeric SMILES

CCCCCCCCCC(=O)OC1=C(C=C(C=C1)C(=O)OC2=CC=C(C=C2)C(=O)OCCC)F

InChI

InChI=1S/C27H33FO6/c1-3-5-6-7-8-9-10-11-25(29)34-24-17-14-21(19-23(24)28)27(31)33-22-15-12-20(13-16-22)26(30)32-18-4-2/h12-17,19H,3-11,18H2,1-2H3