2,3-bis(fluoranyl)-4-[[4-(4-octylphenyl)phenyl]methoxy]benzenecarbonitrile

Systemtic Name: 2,3-bis(fluoranyl)-4-[[4-(4-octylphenyl)phenyl]methoxy]benzenecarbonitrile Openeye Name: 2,3-difluoro-4-[[4-(4-octylphenyl)phenyl]methoxy]benzonitrile CAS Name: 2,3-difluoro-4-[[4-(4-octylphenyl)phenyl]methoxy]benzonitrile IUPAC Name: 2,3-difluoro-4-[[4-(4-octylphenyl)phenyl]methoxy]benzonitrile Traditional Name: 2,3-difluoro-4-[4-(4-octylphenyl)benzyl]oxy-benzonitrile Formula: C28H29F2NO MolecularWeight: 433.532766

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC1=CC=C(C=C1)C2=CC=C(C=C2)COC3=C(C(=C(C=C3)C#N)F)F

Isomeric SMILES

CCCCCCCCC1=CC=C(C=C1)C2=CC=C(C=C2)COC3=C(C(=C(C=C3)C#N)F)F

InChI

InChI=1S/C28H29F2NO/c1-2-3-4-5-6-7-8-21-9-13-23(14-10-21)24-15-11-22(12-16-24)20-32-26-18-17-25(19-31)27(29)28(26)30/h9-18H,2-8,20H2,1H3