(4-pentan-3-yloxycarbonylphenyl) 4-decanoyloxy-3-fluoranyl-benzoate

Systemtic Name: (4-pentan-3-yloxycarbonylphenyl) 4-decanoyloxy-3-fluoranyl-benzoate Openeye Name: [4-(1-ethylpropoxycarbonyl)phenyl] 4-decanoyloxy-3-fluoro-benzoate CAS Name: 3-fluoro-4-(1-oxodecoxy)benzoic acid [4-[oxo(pentan-3-yloxy)methyl]phenyl] ester IUPAC Name: (4-pentan-3-yloxycarbonylphenyl) 4-decanoyloxy-3-fluorobenzoate Traditional Name: 4-capryloxy-3-fluoro-benzoic acid [4-(1-ethylpropoxycarbonyl)phenyl] ester Formula: C29H37FO6 MolecularWeight: 500.598883

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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)OC(CC)CC)F

Isomeric SMILES

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

InChI

InChI=1S/C29H37FO6/c1-4-7-8-9-10-11-12-13-27(31)36-26-19-16-22(20-25(26)30)29(33)35-24-17-14-21(15-18-24)28(32)34-23(5-2)6-3/h14-20,23H,4-13H2,1-3H3