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

Systemtic Name: heptyl 3-(2-fluoranyl-4-heptyl-phenyl)-4-phenyl-benzenecarboperoxoate Openeye Name: heptyl 3-(2-fluoro-4-heptyl-phenyl)-4-phenyl-benzenecarboperoxoate CAS Name: 3-(2-fluoro-4-heptylphenyl)-4-phenylbenzenecarboperoxoic acid heptyl ester IUPAC Name: heptyl 3-(2-fluoro-4-heptylphenyl)-4-phenylbenzenecarboperoxoate Traditional Name: 3-(2-fluoro-4-heptyl-phenyl)-4-phenyl-benzenecarboperoxoic acid heptyl ester Formula: C33H41FO3 MolecularWeight: 504.675243

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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=C3)F

Isomeric SMILES

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

InChI

InChI=1S/C33H41FO3/c1-3-5-7-9-12-16-26-19-21-30(32(34)24-26)31-25-28(20-22-29(31)27-17-13-11-14-18-27)33(35)37-36-23-15-10-8-6-4-2/h11,13-14,17-22,24-25H,3-10,12,15-16,23H2,1-2H3