4-[4-(6-heptylpyridin-3-yl)phenyl]benzenecarbonitrile

Systemtic Name: 4-[4-(6-heptylpyridin-3-yl)phenyl]benzenecarbonitrile Openeye Name: 4-[4-(6-heptyl-3-pyridyl)phenyl]benzonitrile CAS Name: 4-[4-(6-heptyl-3-pyridinyl)phenyl]benzonitrile IUPAC Name: 4-[4-(6-heptylpyridin-3-yl)phenyl]benzonitrile Traditional Name: 4-[4-(6-heptyl-3-pyridyl)phenyl]benzonitrile Formula: C25H26N2 MolecularWeight: 354.48734

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H26N2/c1-2-3-4-5-6-7-25-17-16-24(19-27-25)23-14-12-22(13-15-23)21-10-8-20(18-26)9-11-21/h8-17,19H,2-7H2,1H3