6-[4-[2-(4-heptylphenyl)ethyl]phenyl]pyridine-3-carbonitrile

Systemtic Name: 6-[4-[2-(4-heptylphenyl)ethyl]phenyl]pyridine-3-carbonitrile Openeye Name: 6-[4-[2-(4-heptylphenyl)ethyl]phenyl]pyridine-3-carbonitrile CAS Name: 6-[4-[2-(4-heptylphenyl)ethyl]phenyl]-3-pyridinecarbonitrile IUPAC Name: 6-[4-[2-(4-heptylphenyl)ethyl]phenyl]pyridine-3-carbonitrile Traditional Name: 6-[4-[2-(4-heptylphenyl)ethyl]phenyl]nicotinonitrile Formula: C27H30N2 MolecularWeight: 382.5405

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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