octyl 2-fluoranyl-3-(2-fluoranyl-4-octyl-phenyl)-4-phenyl-benzenecarboperoxoate

Systemtic Name: octyl 2-fluoranyl-3-(2-fluoranyl-4-octyl-phenyl)-4-phenyl-benzenecarboperoxoate Openeye Name: octyl 2-fluoro-3-(2-fluoro-4-octyl-phenyl)-4-phenyl-benzenecarboperoxoate CAS Name: 2-fluoro-3-(2-fluoro-4-octylphenyl)-4-phenylbenzenecarboperoxoic acid octyl ester IUPAC Name: octyl 2-fluoro-3-(2-fluoro-4-octylphenyl)-4-phenylbenzenecarboperoxoate Traditional Name: 2-fluoro-3-(2-fluoro-4-octyl-phenyl)-4-phenyl-benzenecarboperoxoic acid octyl ester Formula: C35H44F2O3 MolecularWeight: 550.718866

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC1=CC(=C(C=C1)C2=C(C=CC(=C2F)C(=O)OOCCCCCCCC)C3=CC=CC=C3)F

Isomeric SMILES

CCCCCCCCC1=CC(=C(C=C1)C2=C(C=CC(=C2F)C(=O)OOCCCCCCCC)C3=CC=CC=C3)F

InChI

InChI=1S/C35H44F2O3/c1-3-5-7-9-11-14-18-27-21-22-30(32(36)26-27)33-29(28-19-15-13-16-20-28)23-24-31(34(33)37)35(38)40-39-25-17-12-10-8-6-4-2/h13,15-16,19-24,26H,3-12,14,17-18,25H2,1-2H3