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

Systemtic Name: 3-(2-fluoranyldecanoyloxy)-2-(4-nonan-2-yloxycarbonylphenyl)benzoate Openeye Name: 3-(2-fluorodecanoyloxy)-2-[4-(1-methyloctoxycarbonyl)phenyl]benzoate CAS Name: 3-(2-fluoro-1-oxodecoxy)-2-[4-[nonan-2-yloxy(oxo)methyl]phenyl]benzoate IUPAC Name: 3-(2-fluorodecanoyloxy)-2-(4-nonan-2-yloxycarbonylphenyl)benzoate Traditional Name: 3-(2-fluorodecanoyloxy)-2-[4-(1-methyloctoxycarbonyl)phenyl]benzoate Formula: C33H44FO6- MolecularWeight: 555.697263

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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)CCCCCCC)C(=O)[O-])F

Isomeric SMILES

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

InChI

InChI=1S/C33H45FO6/c1-4-6-8-10-12-14-18-28(34)33(38)40-29-19-15-17-27(31(35)36)30(29)25-20-22-26(23-21-25)32(37)39-24(3)16-13-11-9-7-5-2/h15,17,19-24,28H,4-14,16,18H2,1-3H3,(H,35,36)/p-1