4-[4-(6-butyl-1-fluoranyl-naphthalen-2-yl)-2-fluoranyl-phenyl]-2-fluoranyl-benzenecarbonitrile

Systemtic Name: 4-[4-(6-butyl-1-fluoranyl-naphthalen-2-yl)-2-fluoranyl-phenyl]-2-fluoranyl-benzenecarbonitrile Openeye Name: 4-[4-(6-butyl-1-fluoro-2-naphthyl)-2-fluoro-phenyl]-2-fluoro-benzonitrile CAS Name: 4-[4-(6-butyl-1-fluoro-2-naphthalenyl)-2-fluorophenyl]-2-fluorobenzonitrile IUPAC Name: 4-[4-(6-butyl-1-fluoronaphthalen-2-yl)-2-fluorophenyl]-2-fluorobenzonitrile Traditional Name: 4-[4-(6-butyl-1-fluoro-2-naphthyl)-2-fluoro-phenyl]-2-fluoro-benzonitrile Formula: C27H20F3N MolecularWeight: 415.44961

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC2=C(C=C1)C(=C(C=C2)C3=CC(=C(C=C3)C4=CC(=C(C=C4)C#N)F)F)F

Isomeric SMILES

CCCCC1=CC2=C(C=C1)C(=C(C=C2)C3=CC(=C(C=C3)C4=CC(=C(C=C4)C#N)F)F)F

InChI

InChI=1S/C27H20F3N/c1-2-3-4-17-5-10-23-18(13-17)9-12-24(27(23)30)20-8-11-22(26(29)15-20)19-6-7-21(16-31)25(28)14-19/h5-15H,2-4H2,1H3