4-[5-[2-(4-heptylphenyl)ethyl]pyridin-2-yl]benzenecarbonitrile

Systemtic Name: 4-[5-[2-(4-heptylphenyl)ethyl]pyridin-2-yl]benzenecarbonitrile Openeye Name: 4-[5-[2-(4-heptylphenyl)ethyl]-2-pyridyl]benzonitrile CAS Name: 4-[5-[2-(4-heptylphenyl)ethyl]-2-pyridinyl]benzonitrile IUPAC Name: 4-[5-[2-(4-heptylphenyl)ethyl]pyridin-2-yl]benzonitrile Traditional Name: 4-[5-[2-(4-heptylphenyl)ethyl]-2-pyridyl]benzonitrile Formula: C27H30N2 MolecularWeight: 382.5405

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC1=CC=C(C=C1)CCC2=CN=C(C=C2)C3=CC=C(C=C3)C#N

Isomeric SMILES

CCCCCCCC1=CC=C(C=C1)CCC2=CN=C(C=C2)C3=CC=C(C=C3)C#N

InChI

InChI=1S/C27H30N2/c1-2-3-4-5-6-7-22-8-10-23(11-9-22)12-13-25-16-19-27(29-21-25)26-17-14-24(20-28)15-18-26/h8-11,14-19,21H,2-7,12-13H2,1H3