2-[1-(2-chlorophenyl)-3-oxidanylidene-butyl]propanedinitrile

Systemtic Name: 2-[1-(2-chlorophenyl)-3-oxidanylidene-butyl]propanedinitrile Openeye Name: 2-[1-(2-chlorophenyl)-3-oxo-butyl]propanedinitrile CAS Name: 2-[1-(2-chlorophenyl)-3-oxobutyl]propanedinitrile IUPAC Name: 2-[1-(2-chlorophenyl)-3-oxobutyl]propanedinitrile Traditional Name: 2-[1-(2-chlorophenyl)-3-keto-butyl]malononitrile Formula: C13H11ClN2O MolecularWeight: 246.69224

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)CC(C1=CC=CC=C1Cl)C(C#N)C#N

Isomeric SMILES

CC(=O)CC(C1=CC=CC=C1Cl)C(C#N)C#N

InChI

InChI=1S/C13H11ClN2O/c1-9(17)6-12(10(7-15)8-16)11-4-2-3-5-13(11)14/h2-5,10,12H,6H2,1H3