[4-(4-hexylphenyl)phenyl] 3-fluoranyl-4-heptoxy-benzoate

Systemtic Name: [4-(4-hexylphenyl)phenyl] 3-fluoranyl-4-heptoxy-benzoate Openeye Name: [4-(4-hexylphenyl)phenyl] 3-fluoro-4-heptoxy-benzoate CAS Name: 3-fluoro-4-heptoxybenzoic acid [4-(4-hexylphenyl)phenyl] ester IUPAC Name: [4-(4-hexylphenyl)phenyl] 3-fluoro-4-heptoxybenzoate Traditional Name: 3-fluoro-4-heptoxy-benzoic acid [4-(4-hexylphenyl)phenyl] ester Formula: C32H39FO3 MolecularWeight: 490.648663

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCOC1=C(C=C(C=C1)C(=O)OC2=CC=C(C=C2)C3=CC=C(C=C3)CCCCCC)F

Isomeric SMILES

CCCCCCCOC1=C(C=C(C=C1)C(=O)OC2=CC=C(C=C2)C3=CC=C(C=C3)CCCCCC)F

InChI

InChI=1S/C32H39FO3/c1-3-5-7-9-11-23-35-31-22-19-28(24-30(31)33)32(34)36-29-20-17-27(18-21-29)26-15-13-25(14-16-26)12-10-8-6-4-2/h13-22,24H,3-12,23H2,1-2H3