3-(2-fluoranyldecanoyloxy)-2-(4-pentan-2-yloxycarbonylphenyl)benzoate

Systemtic Name: 3-(2-fluoranyldecanoyloxy)-2-(4-pentan-2-yloxycarbonylphenyl)benzoate Openeye Name: 3-(2-fluorodecanoyloxy)-2-[4-(1-methylbutoxycarbonyl)phenyl]benzoate CAS Name: 3-(2-fluoro-1-oxodecoxy)-2-[4-[oxo(pentan-2-yloxy)methyl]phenyl]benzoate IUPAC Name: 3-(2-fluorodecanoyloxy)-2-(4-pentan-2-yloxycarbonylphenyl)benzoate Traditional Name: 3-(2-fluorodecanoyloxy)-2-[4-(1-methylbutoxycarbonyl)phenyl]benzoate Formula: C29H36FO6- MolecularWeight: 499.590943

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC(C(=O)OC1=CC=CC(=C1C2=CC=C(C=C2)C(=O)OC(C)CCC)C(=O)[O-])F

Isomeric SMILES

CCCCCCCCC(C(=O)OC1=CC=CC(=C1C2=CC=C(C=C2)C(=O)OC(C)CCC)C(=O)[O-])F

InChI

InChI=1S/C29H37FO6/c1-4-6-7-8-9-10-14-24(30)29(34)36-25-15-11-13-23(27(31)32)26(25)21-16-18-22(19-17-21)28(33)35-20(3)12-5-2/h11,13,15-20,24H,4-10,12,14H2,1-3H3,(H,31,32)/p-1