[4-(4-octoxyphenyl)phenyl] 2-fluoranyl-4-propoxy-butanoate

Systemtic Name: [4-(4-octoxyphenyl)phenyl] 2-fluoranyl-4-propoxy-butanoate Openeye Name: [4-(4-octoxyphenyl)phenyl] 2-fluoro-4-propoxy-butanoate CAS Name: 2-fluoro-4-propoxybutanoic acid [4-(4-octoxyphenyl)phenyl] ester IUPAC Name: [4-(4-octoxyphenyl)phenyl] 2-fluoro-4-propoxybutanoate Traditional Name: 2-fluoro-4-propoxy-butyric acid [4-(4-octoxyphenyl)phenyl] ester Formula: C27H37FO4 MolecularWeight: 444.578683

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C27H37FO4/c1-3-5-6-7-8-9-20-31-24-14-10-22(11-15-24)23-12-16-25(17-13-23)32-27(29)26(28)18-21-30-19-4-2/h10-17,26H,3-9,18-21H2,1-2H3