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

Systemtic Name: 4-[2,6-bis(fluoranyl)-4-(1-fluoranyl-6-pentyl-naphthalen-2-yl)phenyl]benzenecarbonitrile Openeye Name: 4-[2,6-difluoro-4-(1-fluoro-6-pentyl-2-naphthyl)phenyl]benzonitrile CAS Name: 4-[2,6-difluoro-4-(1-fluoro-6-pentyl-2-naphthalenyl)phenyl]benzonitrile IUPAC Name: 4-[2,6-difluoro-4-(1-fluoro-6-pentylnaphthalen-2-yl)phenyl]benzonitrile Traditional Name: 4-[4-(6-amyl-1-fluoro-2-naphthyl)-2,6-difluoro-phenyl]benzonitrile Formula: C28H22F3N MolecularWeight: 429.47619

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=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

CCCCCC1=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/C28H22F3N/c1-2-3-4-5-18-8-12-23-21(14-18)11-13-24(28(23)31)22-15-25(29)27(26(30)16-22)20-9-6-19(17-32)7-10-20/h6-16H,2-5H2,1H3