4-[(3E)-1-cyano-3-[methoxy(oxidanyl)methylidene]-4-oxidanylidene-cyclohexyl]benzenecarbonitrile

Systemtic Name: 4-[(3E)-1-cyano-3-[methoxy(oxidanyl)methylidene]-4-oxidanylidene-cyclohexyl]benzenecarbonitrile Openeye Name: 4-[(3E)-1-cyano-3-[hydroxy(methoxy)methylene]-4-oxo-cyclohexyl]benzonitrile CAS Name: 4-[(3E)-1-cyano-3-[hydroxy(methoxy)methylidene]-4-oxocyclohexyl]benzonitrile IUPAC Name: 4-[(3E)-1-cyano-3-[hydroxy(methoxy)methylidene]-4-oxocyclohexyl]benzonitrile Traditional Name: 4-[(3E)-1-cyano-3-[hydroxy(methoxy)methylene]-4-keto-cyclohexyl]benzonitrile Formula: C16H14N2O3 MolecularWeight: 282.29396

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H14N2O3/c1-21-15(20)13-8-16(10-18,7-6-14(13)19)12-4-2-11(9-17)3-5-12/h2-5,20H,6-8H2,1H3/b15-13+