3-(3-cyclopentyloxy-4-methoxy-phenyl)-3-oxidanylidene-2-pyridin-4-yl-propanenitrile

Systemtic Name: 3-(3-cyclopentyloxy-4-methoxy-phenyl)-3-oxidanylidene-2-pyridin-4-yl-propanenitrile Openeye Name: 3-[3-(cyclopentoxy)-4-methoxy-phenyl]-3-oxo-2-(4-pyridyl)propanenitrile CAS Name: 3-(3-cyclopentyloxy-4-methoxyphenyl)-3-oxo-2-pyridin-4-ylpropanenitrile IUPAC Name: 3-(3-cyclopentyloxy-4-methoxyphenyl)-3-oxo-2-pyridin-4-ylpropanenitrile Traditional Name: 3-[3-(cyclopentoxy)-4-methoxy-phenyl]-3-keto-2-(4-pyridyl)propionitrile Formula: C20H20N2O3 MolecularWeight: 336.3844

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)C(C#N)C2=CC=NC=C2)OC3CCCC3

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)C(C#N)C2=CC=NC=C2)OC3CCCC3

InChI

InChI=1S/C20H20N2O3/c1-24-18-7-6-15(12-19(18)25-16-4-2-3-5-16)20(23)17(13-21)14-8-10-22-11-9-14/h6-12,16-17H,2-5H2,1H3