(3E)-3-[methoxy(oxidanyl)methylidene]-4-oxidanylidene-1-pyridin-2-yl-cyclohexane-1-carbonitrile

Systemtic Name: (3E)-3-[methoxy(oxidanyl)methylidene]-4-oxidanylidene-1-pyridin-2-yl-cyclohexane-1-carbonitrile Openeye Name: (3E)-3-[hydroxy(methoxy)methylene]-4-oxo-1-(2-pyridyl)cyclohexanecarbonitrile CAS Name: (3E)-3-[hydroxy(methoxy)methylidene]-4-oxo-1-(2-pyridinyl)-1-cyclohexanecarbonitrile IUPAC Name: (3E)-3-[hydroxy(methoxy)methylidene]-4-oxo-1-pyridin-2-ylcyclohexane-1-carbonitrile Traditional Name: (3E)-3-[hydroxy(methoxy)methylene]-4-keto-1-(2-pyridyl)cyclohexanecarbonitrile Formula: C14H14N2O3 MolecularWeight: 258.27256

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Descriptors Computed from Structure

Canonical SMILES:

COC(=C1CC(CCC1=O)(C#N)C2=CC=CC=N2)O

Isomeric SMILES

CO/C(=C/1\CC(CCC1=O)(C#N)C2=CC=CC=N2)/O

InChI

InChI=1S/C14H14N2O3/c1-19-13(18)10-8-14(9-15,6-5-11(10)17)12-4-2-3-7-16-12/h2-4,7,18H,5-6,8H2,1H3/b13-10+