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

Systemtic Name: [4-[3-(trifluoromethyl)nonyl]phenyl] 4-(4-dodecoxyphenyl)benzoate Openeye Name: [4-[3-(trifluoromethyl)nonyl]phenyl] 4-(4-dodecoxyphenyl)benzoate CAS Name: 4-(4-dodecoxyphenyl)benzoic acid [4-[3-(trifluoromethyl)nonyl]phenyl] ester IUPAC Name: [4-[3-(trifluoromethyl)nonyl]phenyl] 4-(4-dodecoxyphenyl)benzoate Traditional Name: 4-(4-lauryloxyphenyl)benzoic acid [4-[3-(trifluoromethyl)nonyl]phenyl] ester Formula: C41H55F3O3 MolecularWeight: 652.86881

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C41H55F3O3/c1-3-5-7-9-10-11-12-13-14-16-32-46-38-30-25-35(26-31-38)34-21-23-36(24-22-34)40(45)47-39-28-19-33(20-29-39)18-27-37(41(42,43)44)17-15-8-6-4-2/h19-26,28-31,37H,3-18,27,32H2,1-2H3