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

Systemtic Name: octyl 2-fluoranyl-3-(2-fluoranyl-4-hexyl-phenyl)-4-phenyl-benzenecarboperoxoate Openeye Name: octyl 2-fluoro-3-(2-fluoro-4-hexyl-phenyl)-4-phenyl-benzenecarboperoxoate CAS Name: 2-fluoro-3-(2-fluoro-4-hexylphenyl)-4-phenylbenzenecarboperoxoic acid octyl ester IUPAC Name: octyl 2-fluoro-3-(2-fluoro-4-hexylphenyl)-4-phenylbenzenecarboperoxoate Traditional Name: 2-fluoro-3-(2-fluoro-4-hexyl-phenyl)-4-phenyl-benzenecarboperoxoic acid octyl ester Formula: C33H40F2O3 MolecularWeight: 522.665706

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOOC(=O)C1=C(C(=C(C=C1)C2=CC=CC=C2)C3=C(C=C(C=C3)CCCCCC)F)F

Isomeric SMILES

CCCCCCCCOOC(=O)C1=C(C(=C(C=C1)C2=CC=CC=C2)C3=C(C=C(C=C3)CCCCCC)F)F

InChI

InChI=1S/C33H40F2O3/c1-3-5-7-9-10-15-23-37-38-33(36)29-22-21-27(26-17-13-11-14-18-26)31(32(29)35)28-20-19-25(24-30(28)34)16-12-8-6-4-2/h11,13-14,17-22,24H,3-10,12,15-16,23H2,1-2H3