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

Systemtic Name: [4-(3-fluoranyl-4-hexoxy-phenyl)phenyl] nonanoate Openeye Name: [4-(3-fluoro-4-hexoxy-phenyl)phenyl] nonanoate CAS Name: nonanoic acid [4-(3-fluoro-4-hexoxyphenyl)phenyl] ester IUPAC Name: [4-(3-fluoro-4-hexoxyphenyl)phenyl] nonanoate Traditional Name: pelargonic acid [4-(3-fluoro-4-hexoxy-phenyl)phenyl] ester Formula: C27H37FO3 MolecularWeight: 428.579283

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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