4-(7-butyl-3-fluoranyl-phenanthren-2-yl)-2-fluoranyl-benzenecarbonitrile

Systemtic Name: 4-(7-butyl-3-fluoranyl-phenanthren-2-yl)-2-fluoranyl-benzenecarbonitrile Openeye Name: 4-(7-butyl-3-fluoro-2-phenanthryl)-2-fluoro-benzonitrile CAS Name: 4-(7-butyl-3-fluoro-2-phenanthrenyl)-2-fluorobenzonitrile IUPAC Name: 4-(7-butyl-3-fluorophenanthren-2-yl)-2-fluorobenzonitrile Traditional Name: 4-(7-butyl-3-fluoro-2-phenanthryl)-2-fluoro-benzonitrile Formula: C25H19F2N MolecularWeight: 371.421866

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC2=C(C=C1)C3=CC(=C(C=C3C=C2)C4=CC(=C(C=C4)C#N)F)F

Isomeric SMILES

CCCCC1=CC2=C(C=C1)C3=CC(=C(C=C3C=C2)C4=CC(=C(C=C4)C#N)F)F

InChI

InChI=1S/C25H19F2N/c1-2-3-4-16-5-10-21-17(11-16)6-7-18-12-23(25(27)14-22(18)21)19-8-9-20(15-28)24(26)13-19/h5-14H,2-4H2,1H3