5-methoxy-2-(2-methylphenyl)-3-oxidanylidene-pentanenitrile

Systemtic Name: 5-methoxy-2-(2-methylphenyl)-3-oxidanylidene-pentanenitrile Openeye Name: 5-methoxy-2-(o-tolyl)-3-oxo-pentanenitrile CAS Name: 5-methoxy-2-(2-methylphenyl)-3-oxopentanenitrile IUPAC Name: 5-methoxy-2-(2-methylphenyl)-3-oxopentanenitrile Traditional Name: 3-keto-5-methoxy-2-(o-tolyl)valeronitrile Formula: C13H15NO2 MolecularWeight: 217.2637

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C(C#N)C(=O)CCOC

Isomeric SMILES

CC1=CC=CC=C1C(C#N)C(=O)CCOC

InChI

InChI=1S/C13H15NO2/c1-10-5-3-4-6-11(10)12(9-14)13(15)7-8-16-2/h3-6,12H,7-8H2,1-2H3