7-fluoranyl-8-[6-(2-fluoranyl-4-octoxy-phenyl)pyridin-3-yl]oxy-octan-4-one

Systemtic Name: 7-fluoranyl-8-[6-(2-fluoranyl-4-octoxy-phenyl)pyridin-3-yl]oxy-octan-4-one Openeye Name: 7-fluoro-8-[[6-(2-fluoro-4-octoxy-phenyl)-3-pyridyl]oxy]octan-4-one CAS Name: 7-fluoro-8-[[6-(2-fluoro-4-octoxyphenyl)-3-pyridinyl]oxy]-4-octanone IUPAC Name: 7-fluoro-8-[6-(2-fluoro-4-octoxyphenyl)pyridin-3-yl]oxyoctan-4-one Traditional Name: 7-fluoro-8-[[6-(2-fluoro-4-octoxy-phenyl)-3-pyridyl]oxy]octan-4-one Formula: C27H37F2NO3 MolecularWeight: 461.584386

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOC1=CC(=C(C=C1)C2=NC=C(C=C2)OCC(CCC(=O)CCC)F)F

Isomeric SMILES

CCCCCCCCOC1=CC(=C(C=C1)C2=NC=C(C=C2)OCC(CCC(=O)CCC)F)F

InChI

InChI=1S/C27H37F2NO3/c1-3-5-6-7-8-9-17-32-23-13-15-25(26(29)18-23)27-16-14-24(19-30-27)33-20-21(28)11-12-22(31)10-4-2/h13-16,18-19,21H,3-12,17,20H2,1-2H3