(4-octoxyphenyl) 3-fluoranyl-4-hexoxy-benzoate

Systemtic Name: (4-octoxyphenyl) 3-fluoranyl-4-hexoxy-benzoate Openeye Name: (4-octoxyphenyl) 3-fluoro-4-hexoxy-benzoate CAS Name: 3-fluoro-4-hexoxybenzoic acid (4-octoxyphenyl) ester IUPAC Name: (4-octoxyphenyl) 3-fluoro-4-hexoxybenzoate Traditional Name: 3-fluoro-4-hexoxy-benzoic acid (4-octoxyphenyl) ester Formula: C27H37FO4 MolecularWeight: 444.578683

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C27H37FO4/c1-3-5-7-9-10-12-19-30-23-14-16-24(17-15-23)32-27(29)22-13-18-26(25(28)21-22)31-20-11-8-6-4-2/h13-18,21H,3-12,19-20H2,1-2H3