3-[3-(3-pyridin-4-ylpropoxy)pyridin-2-yl]oxybenzenecarbonitrile

Systemtic Name: 3-[3-(3-pyridin-4-ylpropoxy)pyridin-2-yl]oxybenzenecarbonitrile Openeye Name: 3-[[3-[3-(4-pyridyl)propoxy]-2-pyridyl]oxy]benzonitrile CAS Name: 3-[[3-(3-pyridin-4-ylpropoxy)-2-pyridinyl]oxy]benzonitrile IUPAC Name: 3-[3-(3-pyridin-4-ylpropoxy)pyridin-2-yl]oxybenzonitrile Traditional Name: 3-[[3-[3-(4-pyridyl)propoxy]-2-pyridyl]oxy]benzonitrile Formula: C20H17N3O2 MolecularWeight: 331.36788

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)OC2=C(C=CC=N2)OCCCC3=CC=NC=C3)C#N

Isomeric SMILES

C1=CC(=CC(=C1)OC2=C(C=CC=N2)OCCCC3=CC=NC=C3)C#N

InChI

InChI=1S/C20H17N3O2/c21-15-17-4-1-6-18(14-17)25-20-19(7-2-10-23-20)24-13-3-5-16-8-11-22-12-9-16/h1-2,4,6-12,14H,3,5,13H2