[2-fluoranyl-4-(2-methylbutyl)phenyl] 4-(4-octoxyphenyl)benzoate

Systemtic Name: [2-fluoranyl-4-(2-methylbutyl)phenyl] 4-(4-octoxyphenyl)benzoate Openeye Name: [2-fluoro-4-(2-methylbutyl)phenyl] 4-(4-octoxyphenyl)benzoate CAS Name: 4-(4-octoxyphenyl)benzoic acid [2-fluoro-4-(2-methylbutyl)phenyl] ester IUPAC Name: [2-fluoro-4-(2-methylbutyl)phenyl] 4-(4-octoxyphenyl)benzoate Traditional Name: 4-(4-octoxyphenyl)benzoic acid [2-fluoro-4-(2-methylbutyl)phenyl] ester Formula: C32H39FO3 MolecularWeight: 490.648663

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOC1=CC=C(C=C1)C2=CC=C(C=C2)C(=O)OC3=C(C=C(C=C3)CC(C)CC)F

Isomeric SMILES

CCCCCCCCOC1=CC=C(C=C1)C2=CC=C(C=C2)C(=O)OC3=C(C=C(C=C3)CC(C)CC)F

InChI

InChI=1S/C32H39FO3/c1-4-6-7-8-9-10-21-35-29-18-16-27(17-19-29)26-12-14-28(15-13-26)32(34)36-31-20-11-25(23-30(31)33)22-24(3)5-2/h11-20,23-24H,4-10,21-22H2,1-3H3