[2-(3-fluoranyl-4-octoxy-phenyl)-2-oxidanylidene-ethyl] 4-hexylbenzoate

Systemtic Name: [2-(3-fluoranyl-4-octoxy-phenyl)-2-oxidanylidene-ethyl] 4-hexylbenzoate Openeye Name: [2-(3-fluoro-4-octoxy-phenyl)-2-oxo-ethyl] 4-hexylbenzoate CAS Name: 4-hexylbenzoic acid [2-(3-fluoro-4-octoxyphenyl)-2-oxoethyl] ester IUPAC Name: [2-(3-fluoro-4-octoxyphenyl)-2-oxoethyl] 4-hexylbenzoate Traditional Name: 4-hexylbenzoic acid [2-(3-fluoro-4-octoxy-phenyl)-2-keto-ethyl] ester Formula: C29H39FO4 MolecularWeight: 470.615963

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOC1=C(C=C(C=C1)C(=O)COC(=O)C2=CC=C(C=C2)CCCCCC)F

Isomeric SMILES

CCCCCCCCOC1=C(C=C(C=C1)C(=O)COC(=O)C2=CC=C(C=C2)CCCCCC)F

InChI

InChI=1S/C29H39FO4/c1-3-5-7-9-10-12-20-33-28-19-18-25(21-26(28)30)27(31)22-34-29(32)24-16-14-23(15-17-24)13-11-8-6-4-2/h14-19,21H,3-13,20,22H2,1-2H3