2-(2-oxidanylidenepropyl)-2-phenethyl-propanedinitrile

Systemtic Name: 2-(2-oxidanylidenepropyl)-2-phenethyl-propanedinitrile Openeye Name: 2-acetonyl-2-phenethyl-propanedinitrile CAS Name: 2-(2-oxopropyl)-2-phenethylpropanedinitrile IUPAC Name: 2-(2-oxopropyl)-2-phenethylpropanedinitrile Traditional Name: 2-acetonyl-2-phenethyl-malononitrile Formula: C14H14N2O MolecularWeight: 226.27376

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)CC(CCC1=CC=CC=C1)(C#N)C#N

Isomeric SMILES

CC(=O)CC(CCC1=CC=CC=C1)(C#N)C#N

InChI

InChI=1S/C14H14N2O/c1-12(17)9-14(10-15,11-16)8-7-13-5-3-2-4-6-13/h2-6H,7-9H2,1H3