[4-[3-(trifluoromethyl)heptyl]phenyl] 4-(4-heptylphenyl)benzoate

Systemtic Name: [4-[3-(trifluoromethyl)heptyl]phenyl] 4-(4-heptylphenyl)benzoate Openeye Name: [4-[3-(trifluoromethyl)heptyl]phenyl] 4-(4-heptylphenyl)benzoate CAS Name: 4-(4-heptylphenyl)benzoic acid [4-[3-(trifluoromethyl)heptyl]phenyl] ester IUPAC Name: [4-[3-(trifluoromethyl)heptyl]phenyl] 4-(4-heptylphenyl)benzoate Traditional Name: 4-(4-heptylphenyl)benzoic acid [4-[3-(trifluoromethyl)heptyl]phenyl] ester Formula: C34H41F3O2 MolecularWeight: 538.68335

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC1=CC=C(C=C1)C2=CC=C(C=C2)C(=O)OC3=CC=C(C=C3)CCC(CCCC)C(F)(F)F

Isomeric SMILES

CCCCCCCC1=CC=C(C=C1)C2=CC=C(C=C2)C(=O)OC3=CC=C(C=C3)CCC(CCCC)C(F)(F)F

InChI

InChI=1S/C34H41F3O2/c1-3-5-7-8-9-10-26-12-17-28(18-13-26)29-19-21-30(22-20-29)33(38)39-32-24-15-27(16-25-32)14-23-31(11-6-4-2)34(35,36)37/h12-13,15-22,24-25,31H,3-11,14,23H2,1-2H3