[4-(4-dodecoxyphenyl)phenyl] 3-fluoranyl-4-octoxy-benzoate

Systemtic Name: [4-(4-dodecoxyphenyl)phenyl] 3-fluoranyl-4-octoxy-benzoate Openeye Name: [4-(4-dodecoxyphenyl)phenyl] 3-fluoro-4-octoxy-benzoate CAS Name: 3-fluoro-4-octoxybenzoic acid [4-(4-dodecoxyphenyl)phenyl] ester IUPAC Name: [4-(4-dodecoxyphenyl)phenyl] 3-fluoro-4-octoxybenzoate Traditional Name: 3-fluoro-4-octoxy-benzoic acid [4-(4-lauryloxyphenyl)phenyl] ester Formula: C39H53FO4 MolecularWeight: 604.834123

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C39H53FO4/c1-3-5-7-9-11-12-13-14-16-17-29-42-35-24-19-32(20-25-35)33-21-26-36(27-22-33)44-39(41)34-23-28-38(37(40)31-34)43-30-18-15-10-8-6-4-2/h19-28,31H,3-18,29-30H2,1-2H3