2-fluoranylheptyl 3-(4-heptylphenyl)-4-phenyl-benzenecarboperoxoate

Systemtic Name: 2-fluoranylheptyl 3-(4-heptylphenyl)-4-phenyl-benzenecarboperoxoate Openeye Name: 2-fluoroheptyl 3-(4-heptylphenyl)-4-phenyl-benzenecarboperoxoate CAS Name: 3-(4-heptylphenyl)-4-phenylbenzenecarboperoxoic acid 2-fluoroheptyl ester IUPAC Name: 2-fluoroheptyl 3-(4-heptylphenyl)-4-phenylbenzenecarboperoxoate Traditional Name: 3-(4-heptylphenyl)-4-phenyl-benzenecarboperoxoic acid 2-fluoroheptyl 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)OOCC(CCCCC)F)C3=CC=CC=C3

Isomeric SMILES

CCCCCCCC1=CC=C(C=C1)C2=C(C=CC(=C2)C(=O)OOCC(CCCCC)F)C3=CC=CC=C3

InChI

InChI=1S/C33H41FO3/c1-3-5-7-8-11-14-26-18-20-28(21-19-26)32-24-29(22-23-31(32)27-15-12-9-13-16-27)33(35)37-36-25-30(34)17-10-6-4-2/h9,12-13,15-16,18-24,30H,3-8,10-11,14,17,25H2,1-2H3