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

Systemtic Name: 4-[2,3-bis(fluoranyl)-4-(4-octoxyphenyl)phenyl]benzenecarbonitrile Openeye Name: 4-[2,3-difluoro-4-(4-octoxyphenyl)phenyl]benzonitrile CAS Name: 4-[2,3-difluoro-4-(4-octoxyphenyl)phenyl]benzonitrile IUPAC Name: 4-[2,3-difluoro-4-(4-octoxyphenyl)phenyl]benzonitrile Traditional Name: 4-[2,3-difluoro-4-(4-octoxyphenyl)phenyl]benzonitrile Formula: C27H27F2NO MolecularWeight: 419.506186

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOC1=CC=C(C=C1)C2=C(C(=C(C=C2)C3=CC=C(C=C3)C#N)F)F

Isomeric SMILES

CCCCCCCCOC1=CC=C(C=C1)C2=C(C(=C(C=C2)C3=CC=C(C=C3)C#N)F)F

InChI

InChI=1S/C27H27F2NO/c1-2-3-4-5-6-7-18-31-23-14-12-22(13-15-23)25-17-16-24(26(28)27(25)29)21-10-8-20(19-30)9-11-21/h8-17H,2-7,18H2,1H3