(4-pentylphenyl) 2-fluoranyl-4-(2-heptylphenyl)benzoate

Systemtic Name: (4-pentylphenyl) 2-fluoranyl-4-(2-heptylphenyl)benzoate Openeye Name: (4-pentylphenyl) 2-fluoro-4-(2-heptylphenyl)benzoate CAS Name: 2-fluoro-4-(2-heptylphenyl)benzoic acid (4-pentylphenyl) ester IUPAC Name: (4-pentylphenyl) 2-fluoro-4-(2-heptylphenyl)benzoate Traditional Name: 2-fluoro-4-(2-heptylphenyl)benzoic acid (4-amylphenyl) ester Formula: C31H37FO2 MolecularWeight: 460.622683

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC1=CC=CC=C1C2=CC(=C(C=C2)C(=O)OC3=CC=C(C=C3)CCCCC)F

Isomeric SMILES

CCCCCCCC1=CC=CC=C1C2=CC(=C(C=C2)C(=O)OC3=CC=C(C=C3)CCCCC)F

InChI

InChI=1S/C31H37FO2/c1-3-5-7-8-10-14-25-15-11-12-16-28(25)26-19-22-29(30(32)23-26)31(33)34-27-20-17-24(18-21-27)13-9-6-4-2/h11-12,15-23H,3-10,13-14H2,1-2H3