2-(3-oxidanylidene-1-phenyl-pentyl)propanedinitrile

Systemtic Name: 2-(3-oxidanylidene-1-phenyl-pentyl)propanedinitrile Openeye Name: 2-(3-oxo-1-phenyl-pentyl)propanedinitrile CAS Name: 2-(3-oxo-1-phenylpentyl)propanedinitrile IUPAC Name: 2-(3-oxo-1-phenylpentyl)propanedinitrile Traditional Name: 2-(3-keto-1-phenyl-pentyl)malononitrile Formula: C14H14N2O MolecularWeight: 226.27376

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H14N2O/c1-2-13(17)8-14(12(9-15)10-16)11-6-4-3-5-7-11/h3-7,12,14H,2,8H2,1H3