1-[2-fluoranyl-4-(4-nonanoylphenyl)phenoxy]propan-2-yl hexanoate

Systemtic Name: 1-[2-fluoranyl-4-(4-nonanoylphenyl)phenoxy]propan-2-yl hexanoate Openeye Name: [2-[2-fluoro-4-(4-nonanoylphenyl)phenoxy]-1-methyl-ethyl] hexanoate CAS Name: hexanoic acid 1-[2-fluoro-4-[4-(1-oxononyl)phenyl]phenoxy]propan-2-yl ester IUPAC Name: 1-[2-fluoro-4-(4-nonanoylphenyl)phenoxy]propan-2-yl hexanoate Traditional Name: hexanoic acid [2-[2-fluoro-4-(4-pelargonylphenyl)phenoxy]-1-methyl-ethyl] ester Formula: C30H41FO4 MolecularWeight: 484.642543

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC(=O)C1=CC=C(C=C1)C2=CC(=C(C=C2)OCC(C)OC(=O)CCCCC)F

Isomeric SMILES

CCCCCCCCC(=O)C1=CC=C(C=C1)C2=CC(=C(C=C2)OCC(C)OC(=O)CCCCC)F

InChI

InChI=1S/C30H41FO4/c1-4-6-8-9-10-12-13-28(32)25-17-15-24(16-18-25)26-19-20-29(27(31)21-26)34-22-23(3)35-30(33)14-11-7-5-2/h15-21,23H,4-14,22H2,1-3H3