4-[3-[7-but-3-enyl-2,3,4-tris(fluoranyl)naphthalen-1-yl]phenyl]benzenecarbonitrile

Systemtic Name: 4-[3-[7-but-3-enyl-2,3,4-tris(fluoranyl)naphthalen-1-yl]phenyl]benzenecarbonitrile Openeye Name: 4-[3-(7-but-3-enyl-2,3,4-trifluoro-1-naphthyl)phenyl]benzonitrile CAS Name: 4-[3-(7-but-3-enyl-2,3,4-trifluoro-1-naphthalenyl)phenyl]benzonitrile IUPAC Name: 4-[3-(7-but-3-enyl-2,3,4-trifluoronaphthalen-1-yl)phenyl]benzonitrile Traditional Name: 4-[3-(7-but-3-enyl-2,3,4-trifluoro-1-naphthyl)phenyl]benzonitrile Formula: C27H18F3N MolecularWeight: 413.43373

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C=CCCC1=CC2=C(C=C1)C(=C(C(=C2C3=CC=CC(=C3)C4=CC=C(C=C4)C#N)F)F)F

Isomeric SMILES

C=CCCC1=CC2=C(C=C1)C(=C(C(=C2C3=CC=CC(=C3)C4=CC=C(C=C4)C#N)F)F)F

InChI

InChI=1S/C27H18F3N/c1-2-3-5-17-10-13-22-23(14-17)24(26(29)27(30)25(22)28)21-7-4-6-20(15-21)19-11-8-18(16-31)9-12-19/h2,4,6-15H,1,3,5H2