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

Systemtic Name: [4-[3-(trifluoromethyl)heptyl]phenyl] 4-(4-dodecoxyphenyl)benzoate Openeye Name: [4-[3-(trifluoromethyl)heptyl]phenyl] 4-(4-dodecoxyphenyl)benzoate CAS Name: 4-(4-dodecoxyphenyl)benzoic acid [4-[3-(trifluoromethyl)heptyl]phenyl] ester IUPAC Name: [4-[3-(trifluoromethyl)heptyl]phenyl] 4-(4-dodecoxyphenyl)benzoate Traditional Name: 4-(4-lauryloxyphenyl)benzoic acid [4-[3-(trifluoromethyl)heptyl]phenyl] ester Formula: C39H51F3O3 MolecularWeight: 624.81565

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCOC1=CC=C(C=C1)C2=CC=C(C=C2)C(=O)OC3=CC=C(C=C3)CCC(CCCC)C(F)(F)F

Isomeric SMILES

CCCCCCCCCCCCOC1=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/C39H51F3O3/c1-3-5-7-8-9-10-11-12-13-14-30-44-36-28-23-33(24-29-36)32-19-21-34(22-20-32)38(43)45-37-26-17-31(18-27-37)16-25-35(15-6-4-2)39(40,41)42/h17-24,26-29,35H,3-16,25,30H2,1-2H3