2,6-bis(fluoranyl)-4-(1-fluoranyl-7-pentyl-phenanthren-2-yl)benzenecarbonitrile

Systemtic Name: 2,6-bis(fluoranyl)-4-(1-fluoranyl-7-pentyl-phenanthren-2-yl)benzenecarbonitrile Openeye Name: 2,6-difluoro-4-(1-fluoro-7-pentyl-2-phenanthryl)benzonitrile CAS Name: 2,6-difluoro-4-(1-fluoro-7-pentyl-2-phenanthrenyl)benzonitrile IUPAC Name: 2,6-difluoro-4-(1-fluoro-7-pentylphenanthren-2-yl)benzonitrile Traditional Name: 4-(7-amyl-1-fluoro-2-phenanthryl)-2,6-difluoro-benzonitrile Formula: C26H20F3N MolecularWeight: 403.43891

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=CC2=C(C=C1)C3=C(C=C2)C(=C(C=C3)C4=CC(=C(C(=C4)F)C#N)F)F

Isomeric SMILES

CCCCCC1=CC2=C(C=C1)C3=C(C=C2)C(=C(C=C3)C4=CC(=C(C(=C4)F)C#N)F)F

InChI

InChI=1S/C26H20F3N/c1-2-3-4-5-16-6-8-19-17(12-16)7-9-22-21(19)11-10-20(26(22)29)18-13-24(27)23(15-30)25(28)14-18/h6-14H,2-5H2,1H3