7-[4-[2,3-bis(fluoranyl)octoxy]phenyl]-9-fluoranyl-2-octoxy-phenanthrene

Systemtic Name: 7-[4-[2,3-bis(fluoranyl)octoxy]phenyl]-9-fluoranyl-2-octoxy-phenanthrene Openeye Name: 7-[4-(2,3-difluorooctoxy)phenyl]-9-fluoro-2-octoxy-phenanthrene CAS Name: 7-[4-(2,3-difluorooctoxy)phenyl]-9-fluoro-2-octoxyphenanthrene IUPAC Name: 7-[4-(2,3-difluorooctoxy)phenyl]-9-fluoro-2-octoxyphenanthrene Traditional Name: 7-[4-(2,3-difluorooctoxy)phenyl]-9-fluoro-2-octoxy-phenanthrene Formula: C36H43F3O2 MolecularWeight: 564.72063

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOC1=CC2=CC(=C3C=C(C=CC3=C2C=C1)C4=CC=C(C=C4)OCC(C(CCCCC)F)F)F

Isomeric SMILES

CCCCCCCCOC1=CC2=CC(=C3C=C(C=CC3=C2C=C1)C4=CC=C(C=C4)OCC(C(CCCCC)F)F)F

InChI

InChI=1S/C36H43F3O2/c1-3-5-7-8-9-11-21-40-30-18-20-31-28(22-30)24-35(38)33-23-27(15-19-32(31)33)26-13-16-29(17-14-26)41-25-36(39)34(37)12-10-6-4-2/h13-20,22-24,34,36H,3-12,21,25H2,1-2H3