[4-(3-fluoranyl-4-octoxy-phenyl)phenyl] heptanoate

Systemtic Name: [4-(3-fluoranyl-4-octoxy-phenyl)phenyl] heptanoate Openeye Name: [4-(3-fluoro-4-octoxy-phenyl)phenyl] heptanoate CAS Name: heptanoic acid [4-(3-fluoro-4-octoxyphenyl)phenyl] ester IUPAC Name: [4-(3-fluoro-4-octoxyphenyl)phenyl] heptanoate Traditional Name: enanthic acid [4-(3-fluoro-4-octoxy-phenyl)phenyl] ester Formula: C27H37FO3 MolecularWeight: 428.579283

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOC1=C(C=C(C=C1)C2=CC=C(C=C2)OC(=O)CCCCCC)F

Isomeric SMILES

CCCCCCCCOC1=C(C=C(C=C1)C2=CC=C(C=C2)OC(=O)CCCCCC)F

InChI

InChI=1S/C27H37FO3/c1-3-5-7-9-10-12-20-30-26-19-16-23(21-25(26)28)22-14-17-24(18-15-22)31-27(29)13-11-8-6-4-2/h14-19,21H,3-13,20H2,1-2H3