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

Systemtic Name: [4-(4-pentoxyphenyl)phenyl] 3-fluoranyl-4-(4-hexylphenyl)benzoate Openeye Name: [4-(4-pentoxyphenyl)phenyl] 3-fluoro-4-(4-hexylphenyl)benzoate CAS Name: 3-fluoro-4-(4-hexylphenyl)benzoic acid [4-(4-pentoxyphenyl)phenyl] ester IUPAC Name: [4-(4-pentoxyphenyl)phenyl] 3-fluoro-4-(4-hexylphenyl)benzoate Traditional Name: 3-fluoro-4-(4-hexylphenyl)benzoic acid [4-(4-amoxyphenyl)phenyl] ester Formula: C36H39FO3 MolecularWeight: 538.691463

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1=CC=C(C=C1)C2=C(C=C(C=C2)C(=O)OC3=CC=C(C=C3)C4=CC=C(C=C4)OCCCCC)F

Isomeric SMILES

CCCCCCC1=CC=C(C=C1)C2=C(C=C(C=C2)C(=O)OC3=CC=C(C=C3)C4=CC=C(C=C4)OCCCCC)F

InChI

InChI=1S/C36H39FO3/c1-3-5-7-8-10-27-11-13-30(14-12-27)34-24-19-31(26-35(34)37)36(38)40-33-22-17-29(18-23-33)28-15-20-32(21-16-28)39-25-9-6-4-2/h11-24,26H,3-10,25H2,1-2H3