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

Systemtic Name: 4-[4-(6-butyl-1-fluoranyl-naphthalen-2-yl)-2-fluoranyl-phenyl]benzenecarbonitrile Openeye Name: 4-[4-(6-butyl-1-fluoro-2-naphthyl)-2-fluoro-phenyl]benzonitrile CAS Name: 4-[4-(6-butyl-1-fluoro-2-naphthalenyl)-2-fluorophenyl]benzonitrile IUPAC Name: 4-[4-(6-butyl-1-fluoronaphthalen-2-yl)-2-fluorophenyl]benzonitrile Traditional Name: 4-[4-(6-butyl-1-fluoro-2-naphthyl)-2-fluoro-phenyl]benzonitrile Formula: C27H21F2N MolecularWeight: 397.459146

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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

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

InChI

InChI=1S/C27H21F2N/c1-2-3-4-18-7-12-24-21(15-18)11-14-25(27(24)29)22-10-13-23(26(28)16-22)20-8-5-19(17-30)6-9-20/h5-16H,2-4H2,1H3