[4-(5-octylperoxycarbonyl-2-phenyl-phenyl)phenyl] 2-fluoranyl-2-methyl-heptanoate

Systemtic Name: [4-(5-octylperoxycarbonyl-2-phenyl-phenyl)phenyl] 2-fluoranyl-2-methyl-heptanoate Openeye Name: [4-(5-octylperoxycarbonyl-2-phenyl-phenyl)phenyl] 2-fluoro-2-methyl-heptanoate CAS Name: 2-fluoro-2-methylheptanoic acid [4-[5-[octyldioxy(oxo)methyl]-2-phenylphenyl]phenyl] ester IUPAC Name: [4-(5-octylperoxycarbonyl-2-phenylphenyl)phenyl] 2-fluoro-2-methylheptanoate Traditional Name: 2-fluoro-2-methyl-enanthic acid [4-(5-octylperoxycarbonyl-2-phenyl-phenyl)phenyl] ester Formula: C35H43FO5 MolecularWeight: 562.711323

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOOC(=O)C1=CC(=C(C=C1)C2=CC=CC=C2)C3=CC=C(C=C3)OC(=O)C(C)(CCCCC)F

Isomeric SMILES

CCCCCCCCOOC(=O)C1=CC(=C(C=C1)C2=CC=CC=C2)C3=CC=C(C=C3)OC(=O)C(C)(CCCCC)F

InChI

InChI=1S/C35H43FO5/c1-4-6-8-9-10-15-25-39-41-33(37)29-20-23-31(27-16-12-11-13-17-27)32(26-29)28-18-21-30(22-19-28)40-34(38)35(3,36)24-14-7-5-2/h11-13,16-23,26H,4-10,14-15,24-25H2,1-3H3