2,6-bis(fluoranyl)-4-(7-heptylphenanthren-2-yl)benzenecarbonitrile

Systemtic Name: 2,6-bis(fluoranyl)-4-(7-heptylphenanthren-2-yl)benzenecarbonitrile Openeye Name: 2,6-difluoro-4-(7-heptyl-2-phenanthryl)benzonitrile CAS Name: 2,6-difluoro-4-(7-heptyl-2-phenanthrenyl)benzonitrile IUPAC Name: 2,6-difluoro-4-(7-heptylphenanthren-2-yl)benzonitrile Traditional Name: 2,6-difluoro-4-(7-heptyl-2-phenanthryl)benzonitrile Formula: C28H25F2N MolecularWeight: 413.501606

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC1=CC2=C(C=C1)C3=C(C=C2)C=C(C=C3)C4=CC(=C(C(=C4)F)C#N)F

Isomeric SMILES

CCCCCCCC1=CC2=C(C=C1)C3=C(C=C2)C=C(C=C3)C4=CC(=C(C(=C4)F)C#N)F

InChI

InChI=1S/C28H25F2N/c1-2-3-4-5-6-7-19-8-12-24-21(14-19)9-10-22-15-20(11-13-25(22)24)23-16-27(29)26(18-31)28(30)17-23/h8-17H,2-7H2,1H3