4-[2,6-bis(fluoranyl)-4-(1-fluoranyl-6-hexyl-naphthalen-2-yl)phenyl]benzenecarbonitrile

Systemtic Name: 4-[2,6-bis(fluoranyl)-4-(1-fluoranyl-6-hexyl-naphthalen-2-yl)phenyl]benzenecarbonitrile Openeye Name: 4-[2,6-difluoro-4-(1-fluoro-6-hexyl-2-naphthyl)phenyl]benzonitrile CAS Name: 4-[2,6-difluoro-4-(1-fluoro-6-hexyl-2-naphthalenyl)phenyl]benzonitrile IUPAC Name: 4-[2,6-difluoro-4-(1-fluoro-6-hexylnaphthalen-2-yl)phenyl]benzonitrile Traditional Name: 4-[2,6-difluoro-4-(1-fluoro-6-hexyl-2-naphthyl)phenyl]benzonitrile Formula: C29H24F3N MolecularWeight: 443.50277

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1=CC2=C(C=C1)C(=C(C=C2)C3=CC(=C(C(=C3)F)C4=CC=C(C=C4)C#N)F)F

Isomeric SMILES

CCCCCCC1=CC2=C(C=C1)C(=C(C=C2)C3=CC(=C(C(=C3)F)C4=CC=C(C=C4)C#N)F)F

InChI

InChI=1S/C29H24F3N/c1-2-3-4-5-6-19-9-13-24-22(15-19)12-14-25(29(24)32)23-16-26(30)28(27(31)17-23)21-10-7-20(18-33)8-11-21/h7-17H,2-6H2,1H3