heptyl 3-(2-fluoranyl-4-heptyl-phenyl)-4-(2-fluorophenyl)benzenecarboperoxoate

Systemtic Name: heptyl 3-(2-fluoranyl-4-heptyl-phenyl)-4-(2-fluorophenyl)benzenecarboperoxoate Openeye Name: heptyl 3-(2-fluoro-4-heptyl-phenyl)-4-(2-fluorophenyl)benzenecarboperoxoate CAS Name: 3-(2-fluoro-4-heptylphenyl)-4-(2-fluorophenyl)benzenecarboperoxoic acid heptyl ester IUPAC Name: heptyl 3-(2-fluoro-4-heptylphenyl)-4-(2-fluorophenyl)benzenecarboperoxoate Traditional Name: 3-(2-fluoro-4-heptyl-phenyl)-4-(2-fluorophenyl)benzenecarboperoxoic acid heptyl ester Formula: C33H40F2O3 MolecularWeight: 522.665706

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC1=CC(=C(C=C1)C2=C(C=CC(=C2)C(=O)OOCCCCCCC)C3=CC=CC=C3F)F

Isomeric SMILES

CCCCCCCC1=CC(=C(C=C1)C2=C(C=CC(=C2)C(=O)OOCCCCCCC)C3=CC=CC=C3F)F

InChI

InChI=1S/C33H40F2O3/c1-3-5-7-9-11-15-25-18-20-29(32(35)23-25)30-24-26(33(36)38-37-22-14-10-8-6-4-2)19-21-27(30)28-16-12-13-17-31(28)34/h12-13,16-21,23-24H,3-11,14-15,22H2,1-2H3