4-[3-[3,4-bis(fluoranyl)-7-hexyl-naphthalen-1-yl]phenyl]-2-fluoranyl-benzenecarbonitrile

Systemtic Name: 4-[3-[3,4-bis(fluoranyl)-7-hexyl-naphthalen-1-yl]phenyl]-2-fluoranyl-benzenecarbonitrile Openeye Name: 4-[3-(3,4-difluoro-7-hexyl-1-naphthyl)phenyl]-2-fluoro-benzonitrile CAS Name: 4-[3-(3,4-difluoro-7-hexyl-1-naphthalenyl)phenyl]-2-fluorobenzonitrile IUPAC Name: 4-[3-(3,4-difluoro-7-hexylnaphthalen-1-yl)phenyl]-2-fluorobenzonitrile Traditional Name: 4-[3-(3,4-difluoro-7-hexyl-1-naphthyl)phenyl]-2-fluoro-benzonitrile Formula: C29H24F3N MolecularWeight: 443.50277

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1=CC2=C(C=C1)C(=C(C=C2C3=CC=CC(=C3)C4=CC(=C(C=C4)C#N)F)F)F

Isomeric SMILES

CCCCCCC1=CC2=C(C=C1)C(=C(C=C2C3=CC=CC(=C3)C4=CC(=C(C=C4)C#N)F)F)F

InChI

InChI=1S/C29H24F3N/c1-2-3-4-5-7-19-10-13-24-26(14-19)25(17-28(31)29(24)32)22-9-6-8-20(15-22)21-11-12-23(18-33)27(30)16-21/h6,8-17H,2-5,7H2,1H3