(3-fluoranyl-4-hexoxy-phenyl) 4-octoxybenzoate

Systemtic Name: (3-fluoranyl-4-hexoxy-phenyl) 4-octoxybenzoate Openeye Name: (3-fluoro-4-hexoxy-phenyl) 4-octoxybenzoate CAS Name: 4-octoxybenzoic acid (3-fluoro-4-hexoxyphenyl) ester IUPAC Name: (3-fluoro-4-hexoxyphenyl) 4-octoxybenzoate Traditional Name: 4-octoxybenzoic acid (3-fluoro-4-hexoxy-phenyl) ester Formula: C27H37FO4 MolecularWeight: 444.578683

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOC1=CC=C(C=C1)C(=O)OC2=CC(=C(C=C2)OCCCCCC)F

Isomeric SMILES

CCCCCCCCOC1=CC=C(C=C1)C(=O)OC2=CC(=C(C=C2)OCCCCCC)F

InChI

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