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

Systemtic Name: 4-(1-fluoranyl-7-pentyl-phenanthren-2-yl)benzenecarbonitrile Openeye Name: 4-(1-fluoro-7-pentyl-2-phenanthryl)benzonitrile CAS Name: 4-(1-fluoro-7-pentyl-2-phenanthrenyl)benzonitrile IUPAC Name: 4-(1-fluoro-7-pentylphenanthren-2-yl)benzonitrile Traditional Name: 4-(7-amyl-1-fluoro-2-phenanthryl)benzonitrile Formula: C26H22FN MolecularWeight: 367.457983

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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)C#N)F

Isomeric SMILES

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

InChI

InChI=1S/C26H22FN/c1-2-3-4-5-18-8-12-22-21(16-18)11-13-25-24(22)15-14-23(26(25)27)20-9-6-19(17-28)7-10-20/h6-16H,2-5H2,1H3