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

Systemtic Name: 2-ethyl-4-[2-(4-octylpyridin-2-yl)phenoxy]butanenitrile Openeye Name: 2-ethyl-4-[2-(4-octyl-2-pyridyl)phenoxy]butanenitrile CAS Name: 2-ethyl-4-[2-(4-octyl-2-pyridinyl)phenoxy]butanenitrile IUPAC Name: 2-ethyl-4-[2-(4-octylpyridin-2-yl)phenoxy]butanenitrile Traditional Name: 2-ethyl-4-[2-(4-octyl-2-pyridyl)phenoxy]butyronitrile Formula: C25H34N2O MolecularWeight: 378.55026

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC1=CC(=NC=C1)C2=CC=CC=C2OCCC(CC)C#N

Isomeric SMILES

CCCCCCCCC1=CC(=NC=C1)C2=CC=CC=C2OCCC(CC)C#N

InChI

InChI=1S/C25H34N2O/c1-3-5-6-7-8-9-12-22-15-17-27-24(19-22)23-13-10-11-14-25(23)28-18-16-21(4-2)20-26/h10-11,13-15,17,19,21H,3-9,12,16,18H2,1-2H3