pentan-3-yl 4-(4-decanoyloxyphenyl)carbonyloxy-2-fluoranyl-benzoate

Systemtic Name: pentan-3-yl 4-(4-decanoyloxyphenyl)carbonyloxy-2-fluoranyl-benzoate Openeye Name: 1-ethylpropyl 4-(4-decanoyloxybenzoyl)oxy-2-fluoro-benzoate CAS Name: 2-fluoro-4-[oxo-[4-(1-oxodecoxy)phenyl]methoxy]benzoic acid pentan-3-yl ester IUPAC Name: pentan-3-yl 4-(4-decanoyloxybenzoyl)oxy-2-fluorobenzoate Traditional Name: 4-(4-capryloxybenzoyl)oxy-2-fluoro-benzoic acid 1-ethylpropyl ester Formula: C29H37FO6 MolecularWeight: 500.598883

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CCCCCCCCCC(=O)OC1=CC=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)34-23-16-14-21(15-17-23)28(32)36-24-18-19-25(26(30)20-24)29(33)35-22(5-2)6-3/h14-20,22H,4-13H2,1-3H3