2,4-dimethyl-3-oxidanyl-3-(phenylcarbonyl)pentanedinitrile

Systemtic Name: 2,4-dimethyl-3-oxidanyl-3-(phenylcarbonyl)pentanedinitrile Openeye Name: 3-benzoyl-3-hydroxy-2,4-dimethyl-pentanedinitrile CAS Name: 3-benzoyl-3-hydroxy-2,4-dimethylpentanedinitrile IUPAC Name: 3-benzoyl-3-hydroxy-2,4-dimethylpentanedinitrile Traditional Name: 3-benzoyl-3-hydroxy-2,4-dimethyl-glutaronitrile Formula: C14H14N2O2 MolecularWeight: 242.27316

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H14N2O2/c1-10(8-15)14(18,11(2)9-16)13(17)12-6-4-3-5-7-12/h3-7,10-11,18H,1-2H3