2-(4-methoxyphenyl)-3-oxidanylidene-hexanenitrile

Systemtic Name: 2-(4-methoxyphenyl)-3-oxidanylidene-hexanenitrile Openeye Name: 2-(4-methoxyphenyl)-3-oxo-hexanenitrile CAS Name: 2-(4-methoxyphenyl)-3-oxohexanenitrile IUPAC Name: 2-(4-methoxyphenyl)-3-oxohexanenitrile Traditional Name: 3-keto-2-(4-methoxyphenyl)hexanenitrile Formula: C13H15NO2 MolecularWeight: 217.2637

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)C(C#N)C1=CC=C(C=C1)OC

Isomeric SMILES

CCCC(=O)C(C#N)C1=CC=C(C=C1)OC

InChI

InChI=1S/C13H15NO2/c1-3-4-13(15)12(9-14)10-5-7-11(16-2)8-6-10/h5-8,12H,3-4H2,1-2H3