4-[2-(4-heptylphenyl)phenyl]benzenecarbonitrile

Systemtic Name: 4-[2-(4-heptylphenyl)phenyl]benzenecarbonitrile Openeye Name: 4-[2-(4-heptylphenyl)phenyl]benzonitrile CAS Name: 4-[2-(4-heptylphenyl)phenyl]benzonitrile IUPAC Name: 4-[2-(4-heptylphenyl)phenyl]benzonitrile Traditional Name: 4-[2-(4-heptylphenyl)phenyl]benzonitrile Formula: C26H27N MolecularWeight: 353.49928

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC1=CC=C(C=C1)C2=CC=CC=C2C3=CC=C(C=C3)C#N

Isomeric SMILES

CCCCCCCC1=CC=C(C=C1)C2=CC=CC=C2C3=CC=C(C=C3)C#N

InChI

InChI=1S/C26H27N/c1-2-3-4-5-6-9-21-12-16-23(17-13-21)25-10-7-8-11-26(25)24-18-14-22(20-27)15-19-24/h7-8,10-19H,2-6,9H2,1H3