4-[1,3-bis(fluoranyl)-7-heptyl-phenanthren-2-yl]-2,6-bis(fluoranyl)benzenecarbonitrile

Systemtic Name: 4-[1,3-bis(fluoranyl)-7-heptyl-phenanthren-2-yl]-2,6-bis(fluoranyl)benzenecarbonitrile Openeye Name: 4-(1,3-difluoro-7-heptyl-2-phenanthryl)-2,6-difluoro-benzonitrile CAS Name: 4-(1,3-difluoro-7-heptyl-2-phenanthrenyl)-2,6-difluorobenzonitrile IUPAC Name: 4-(1,3-difluoro-7-heptylphenanthren-2-yl)-2,6-difluorobenzonitrile Traditional Name: 4-(1,3-difluoro-7-heptyl-2-phenanthryl)-2,6-difluoro-benzonitrile Formula: C28H23F4N MolecularWeight: 449.482533

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC1=CC2=C(C=C1)C3=CC(=C(C(=C3C=C2)F)C4=CC(=C(C(=C4)F)C#N)F)F

Isomeric SMILES

CCCCCCCC1=CC2=C(C=C1)C3=CC(=C(C(=C3C=C2)F)C4=CC(=C(C(=C4)F)C#N)F)F

InChI

InChI=1S/C28H23F4N/c1-2-3-4-5-6-7-17-8-10-20-18(12-17)9-11-21-22(20)15-26(31)27(28(21)32)19-13-24(29)23(16-33)25(30)14-19/h8-15H,2-7H2,1H3