2,4,5-tris(fluoranyl)-6-(2-phenylethynyl)-3-(4-propylphenyl)benzenecarbonitrile

Systemtic Name: 2,4,5-tris(fluoranyl)-6-(2-phenylethynyl)-3-(4-propylphenyl)benzenecarbonitrile Openeye Name: 2,4,5-trifluoro-6-(2-phenylethynyl)-3-(4-propylphenyl)benzonitrile CAS Name: 2,4,5-trifluoro-6-(2-phenylethynyl)-3-(4-propylphenyl)benzonitrile IUPAC Name: 2,4,5-trifluoro-6-(2-phenylethynyl)-3-(4-propylphenyl)benzonitrile Traditional Name: 2,4,5-trifluoro-6-(2-phenylethynyl)-3-(4-propylphenyl)benzonitrile Formula: C24H16F3N MolecularWeight: 375.38575

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC=C(C=C1)C2=C(C(=C(C(=C2F)F)C#CC3=CC=CC=C3)C#N)F

Isomeric SMILES

CCCC1=CC=C(C=C1)C2=C(C(=C(C(=C2F)F)C#CC3=CC=CC=C3)C#N)F

InChI

InChI=1S/C24H16F3N/c1-2-6-16-9-12-18(13-10-16)21-22(25)20(15-28)19(23(26)24(21)27)14-11-17-7-4-3-5-8-17/h3-5,7-10,12-13H,2,6H2,1H3