[4-[4-(2-fluoranyl-2-methyl-heptanoyl)oxyphenoxy]carbonylphenyl] 4-octoxybenzoate

Systemtic Name: [4-[4-(2-fluoranyl-2-methyl-heptanoyl)oxyphenoxy]carbonylphenyl] 4-octoxybenzoate Openeye Name: [4-[4-(2-fluoro-2-methyl-heptanoyl)oxyphenoxy]carbonylphenyl] 4-octoxybenzoate CAS Name: 4-octoxybenzoic acid [4-[[4-(2-fluoro-2-methyl-1-oxoheptoxy)phenoxy]-oxomethyl]phenyl] ester IUPAC Name: [4-[4-(2-fluoro-2-methylheptanoyl)oxyphenoxy]carbonylphenyl] 4-octoxybenzoate Traditional Name: 4-octoxybenzoic acid [4-[4-(2-fluoro-2-methyl-heptanoyl)oxyphenoxy]carbonylphenyl] ester Formula: C36H43FO7 MolecularWeight: 606.720823

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOC1=CC=C(C=C1)C(=O)OC2=CC=C(C=C2)C(=O)OC3=CC=C(C=C3)OC(=O)C(C)(CCCCC)F

Isomeric SMILES

CCCCCCCCOC1=CC=C(C=C1)C(=O)OC2=CC=C(C=C2)C(=O)OC3=CC=C(C=C3)OC(=O)C(C)(CCCCC)F

InChI

InChI=1S/C36H43FO7/c1-4-6-8-9-10-12-26-41-29-17-13-27(14-18-29)33(38)42-30-19-15-28(16-20-30)34(39)43-31-21-23-32(24-22-31)44-35(40)36(3,37)25-11-7-5-2/h13-24H,4-12,25-26H2,1-3H3