(4-dodecoxyphenyl) 4-[3-fluoranyl-4-(6-methyloctoxy)phenyl]benzoate

Systemtic Name: (4-dodecoxyphenyl) 4-[3-fluoranyl-4-(6-methyloctoxy)phenyl]benzoate Openeye Name: (4-dodecoxyphenyl) 4-[3-fluoro-4-(6-methyloctoxy)phenyl]benzoate CAS Name: 4-[3-fluoro-4-(6-methyloctoxy)phenyl]benzoic acid (4-dodecoxyphenyl) ester IUPAC Name: (4-dodecoxyphenyl) 4-[3-fluoro-4-(6-methyloctoxy)phenyl]benzoate Traditional Name: 4-[3-fluoro-4-(6-methyloctoxy)phenyl]benzoic acid (4-lauryloxyphenyl) ester Formula: C40H55FO4 MolecularWeight: 618.860703

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCOC1=CC=C(C=C1)OC(=O)C2=CC=C(C=C2)C3=CC(=C(C=C3)OCCCCCC(C)CC)F

Isomeric SMILES

CCCCCCCCCCCCOC1=CC=C(C=C1)OC(=O)C2=CC=C(C=C2)C3=CC(=C(C=C3)OCCCCCC(C)CC)F

InChI

InChI=1S/C40H55FO4/c1-4-6-7-8-9-10-11-12-13-16-29-43-36-24-26-37(27-25-36)45-40(42)34-21-19-33(20-22-34)35-23-28-39(38(41)31-35)44-30-17-14-15-18-32(3)5-2/h19-28,31-32H,4-18,29-30H2,1-3H3