[4-(3-fluoranyl-4-heptoxy-phenyl)phenyl] nonanoate

Systemtic Name: [4-(3-fluoranyl-4-heptoxy-phenyl)phenyl] nonanoate Openeye Name: [4-(3-fluoro-4-heptoxy-phenyl)phenyl] nonanoate CAS Name: nonanoic acid [4-(3-fluoro-4-heptoxyphenyl)phenyl] ester IUPAC Name: [4-(3-fluoro-4-heptoxyphenyl)phenyl] nonanoate Traditional Name: pelargonic acid [4-(3-fluoro-4-heptoxy-phenyl)phenyl] ester Formula: C28H39FO3 MolecularWeight: 442.605863

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC(=O)OC1=CC=C(C=C1)C2=CC(=C(C=C2)OCCCCCCC)F

Isomeric SMILES

CCCCCCCCC(=O)OC1=CC=C(C=C1)C2=CC(=C(C=C2)OCCCCCCC)F

InChI

InChI=1S/C28H39FO3/c1-3-5-7-9-10-12-14-28(30)32-25-18-15-23(16-19-25)24-17-20-27(26(29)22-24)31-21-13-11-8-6-4-2/h15-20,22H,3-14,21H2,1-2H3