4-(1-fluoranyl-7-heptyl-phenanthren-2-yl)benzenecarbonitrile

Systemtic Name: 4-(1-fluoranyl-7-heptyl-phenanthren-2-yl)benzenecarbonitrile Openeye Name: 4-(1-fluoro-7-heptyl-2-phenanthryl)benzonitrile CAS Name: 4-(1-fluoro-7-heptyl-2-phenanthrenyl)benzonitrile IUPAC Name: 4-(1-fluoro-7-heptylphenanthren-2-yl)benzonitrile Traditional Name: 4-(1-fluoro-7-heptyl-2-phenanthryl)benzonitrile Formula: C28H26FN MolecularWeight: 395.511143

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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)C#N)F

Isomeric SMILES

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

InChI

InChI=1S/C28H26FN/c1-2-3-4-5-6-7-20-10-14-24-23(18-20)13-15-27-26(24)17-16-25(28(27)29)22-11-8-21(19-30)9-12-22/h8-18H,2-7H2,1H3