(4-heptan-4-yloxycarbonylphenyl) 4-(4-decanoyloxyphenyl)-2-fluoranyl-benzoate

Systemtic Name: (4-heptan-4-yloxycarbonylphenyl) 4-(4-decanoyloxyphenyl)-2-fluoranyl-benzoate Openeye Name: [4-(1-propylbutoxycarbonyl)phenyl] 4-(4-decanoyloxyphenyl)-2-fluoro-benzoate CAS Name: 2-fluoro-4-[4-(1-oxodecoxy)phenyl]benzoic acid [4-[heptan-4-yloxy(oxo)methyl]phenyl] ester IUPAC Name: (4-heptan-4-yloxycarbonylphenyl) 4-(4-decanoyloxyphenyl)-2-fluorobenzoate Traditional Name: 4-(4-capryloxyphenyl)-2-fluoro-benzoic acid [4-(1-propylbutoxycarbonyl)phenyl] ester Formula: C37H45FO6 MolecularWeight: 604.748003

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCC(=O)OC1=CC=C(C=C1)C2=CC(=C(C=C2)C(=O)OC3=CC=C(C=C3)C(=O)OC(CCC)CCC)F

Isomeric SMILES

CCCCCCCCCC(=O)OC1=CC=C(C=C1)C2=CC(=C(C=C2)C(=O)OC3=CC=C(C=C3)C(=O)OC(CCC)CCC)F

InChI

InChI=1S/C37H45FO6/c1-4-7-8-9-10-11-12-15-35(39)42-31-21-16-27(17-22-31)29-20-25-33(34(38)26-29)37(41)44-32-23-18-28(19-24-32)36(40)43-30(13-5-2)14-6-3/h16-26,30H,4-15H2,1-3H3