2-[2,3-bis(fluoranyl)-4-octoxy-phenyl]-5-(3-fluoranylhexyl)pyridine

Systemtic Name: 2-[2,3-bis(fluoranyl)-4-octoxy-phenyl]-5-(3-fluoranylhexyl)pyridine Openeye Name: 2-(2,3-difluoro-4-octoxy-phenyl)-5-(3-fluorohexyl)pyridine CAS Name: 2-(2,3-difluoro-4-octoxyphenyl)-5-(3-fluorohexyl)pyridine IUPAC Name: 2-(2,3-difluoro-4-octoxyphenyl)-5-(3-fluorohexyl)pyridine Traditional Name: 2-(2,3-difluoro-4-octoxy-phenyl)-5-(3-fluorohexyl)pyridine Formula: C25H34F3NO MolecularWeight: 421.53877

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOC1=C(C(=C(C=C1)C2=NC=C(C=C2)CCC(CCC)F)F)F

Isomeric SMILES

CCCCCCCCOC1=C(C(=C(C=C1)C2=NC=C(C=C2)CCC(CCC)F)F)F

InChI

InChI=1S/C25H34F3NO/c1-3-5-6-7-8-9-17-30-23-16-14-21(24(27)25(23)28)22-15-12-19(18-29-22)11-13-20(26)10-4-2/h12,14-16,18,20H,3-11,13,17H2,1-2H3