2-(4-chlorophenyl)-4-ethoxy-3-oxidanylidene-butanenitrile

Systemtic Name: 2-(4-chlorophenyl)-4-ethoxy-3-oxidanylidene-butanenitrile Openeye Name: 2-(4-chlorophenyl)-4-ethoxy-3-oxo-butanenitrile CAS Name: 2-(4-chlorophenyl)-4-ethoxy-3-oxobutanenitrile IUPAC Name: 2-(4-chlorophenyl)-4-ethoxy-3-oxobutanenitrile Traditional Name: 2-(4-chlorophenyl)-4-ethoxy-3-keto-butyronitrile Formula: C12H12ClNO2 MolecularWeight: 237.68218

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOCC(=O)C(C#N)C1=CC=C(C=C1)Cl

Isomeric SMILES

CCOCC(=O)C(C#N)C1=CC=C(C=C1)Cl

InChI

InChI=1S/C12H12ClNO2/c1-2-16-8-12(15)11(7-14)9-3-5-10(13)6-4-9/h3-6,11H,2,8H2,1H3