2-ethyl-4-[2-(4-hexylpyridin-2-yl)phenoxy]butanenitrile

Systemtic Name: 2-ethyl-4-[2-(4-hexylpyridin-2-yl)phenoxy]butanenitrile Openeye Name: 2-ethyl-4-[2-(4-hexyl-2-pyridyl)phenoxy]butanenitrile CAS Name: 2-ethyl-4-[2-(4-hexyl-2-pyridinyl)phenoxy]butanenitrile IUPAC Name: 2-ethyl-4-[2-(4-hexylpyridin-2-yl)phenoxy]butanenitrile Traditional Name: 2-ethyl-4-[2-(4-hexyl-2-pyridyl)phenoxy]butyronitrile Formula: C23H30N2O MolecularWeight: 350.4971

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1=CC(=NC=C1)C2=CC=CC=C2OCCC(CC)C#N

Isomeric SMILES

CCCCCCC1=CC(=NC=C1)C2=CC=CC=C2OCCC(CC)C#N

InChI

InChI=1S/C23H30N2O/c1-3-5-6-7-10-20-13-15-25-22(17-20)21-11-8-9-12-23(21)26-16-14-19(4-2)18-24/h8-9,11-13,15,17,19H,3-7,10,14,16H2,1-2H3