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

Systemtic Name: 4-[2,6-bis(fluoranyl)-4-(1-fluoranyl-6-heptyl-naphthalen-2-yl)phenyl]benzenecarbonitrile Openeye Name: 4-[2,6-difluoro-4-(1-fluoro-6-heptyl-2-naphthyl)phenyl]benzonitrile CAS Name: 4-[2,6-difluoro-4-(1-fluoro-6-heptyl-2-naphthalenyl)phenyl]benzonitrile IUPAC Name: 4-[2,6-difluoro-4-(1-fluoro-6-heptylnaphthalen-2-yl)phenyl]benzonitrile Traditional Name: 4-[2,6-difluoro-4-(1-fluoro-6-heptyl-2-naphthyl)phenyl]benzonitrile Formula: C30H26F3N MolecularWeight: 457.52935

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC1=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

CCCCCCCC1=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/C30H26F3N/c1-2-3-4-5-6-7-20-10-14-25-23(16-20)13-15-26(30(25)33)24-17-27(31)29(28(32)18-24)22-11-8-21(19-34)9-12-22/h8-18H,2-7H2,1H3