4-[4-[2-(4-octylphenyl)ethyl]phenyl]benzenecarbonitrile

Systemtic Name: 4-[4-[2-(4-octylphenyl)ethyl]phenyl]benzenecarbonitrile Openeye Name: 4-[4-[2-(4-octylphenyl)ethyl]phenyl]benzonitrile CAS Name: 4-[4-[2-(4-octylphenyl)ethyl]phenyl]benzonitrile IUPAC Name: 4-[4-[2-(4-octylphenyl)ethyl]phenyl]benzonitrile Traditional Name: 4-[4-[2-(4-octylphenyl)ethyl]phenyl]benzonitrile Formula: C29H33N MolecularWeight: 395.57902

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC1=CC=C(C=C1)CCC2=CC=C(C=C2)C3=CC=C(C=C3)C#N

Isomeric SMILES

CCCCCCCCC1=CC=C(C=C1)CCC2=CC=C(C=C2)C3=CC=C(C=C3)C#N

InChI

InChI=1S/C29H33N/c1-2-3-4-5-6-7-8-24-9-11-25(12-10-24)13-14-26-15-19-28(20-16-26)29-21-17-27(23-30)18-22-29/h9-12,15-22H,2-8,13-14H2,1H3