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

Systemtic Name: 4-[5-[2-(4-heptoxyphenyl)ethyl]pyridin-2-yl]benzenecarbonitrile Openeye Name: 4-[5-[2-(4-heptoxyphenyl)ethyl]-2-pyridyl]benzonitrile CAS Name: 4-[5-[2-(4-heptoxyphenyl)ethyl]-2-pyridinyl]benzonitrile IUPAC Name: 4-[5-[2-(4-heptoxyphenyl)ethyl]pyridin-2-yl]benzonitrile Traditional Name: 4-[5-[2-(4-heptoxyphenyl)ethyl]-2-pyridyl]benzonitrile Formula: C27H30N2O MolecularWeight: 398.5399

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCOC1=CC=C(C=C1)CCC2=CN=C(C=C2)C3=CC=C(C=C3)C#N

Isomeric SMILES

CCCCCCCOC1=CC=C(C=C1)CCC2=CN=C(C=C2)C3=CC=C(C=C3)C#N

InChI

InChI=1S/C27H30N2O/c1-2-3-4-5-6-19-30-26-16-11-22(12-17-26)7-8-24-13-18-27(29-21-24)25-14-9-23(20-28)10-15-25/h9-18,21H,2-8,19H2,1H3