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

Systemtic Name: 1-[2-fluoranyl-4-(4-nonanoylphenyl)phenoxy]propan-2-yl butanoate Openeye Name: [2-[2-fluoro-4-(4-nonanoylphenyl)phenoxy]-1-methyl-ethyl] butanoate CAS Name: butanoic 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 butanoate Traditional Name: butyric acid [2-[2-fluoro-4-(4-pelargonylphenyl)phenoxy]-1-methyl-ethyl] ester Formula: C28H37FO4 MolecularWeight: 456.589383

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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)CCC)F

Isomeric SMILES

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

InChI

InChI=1S/C28H37FO4/c1-4-6-7-8-9-10-12-26(30)23-15-13-22(14-16-23)24-17-18-27(25(29)19-24)32-20-21(3)33-28(31)11-5-2/h13-19,21H,4-12,20H2,1-3H3