2-[1-(4-tert-butylphenyl)-3-oxidanylidene-3-phenyl-propyl]propanedinitrile

Systemtic Name: 2-[1-(4-tert-butylphenyl)-3-oxidanylidene-3-phenyl-propyl]propanedinitrile Openeye Name: 2-[1-(4-tert-butylphenyl)-3-oxo-3-phenyl-propyl]propanedinitrile CAS Name: 2-[1-(4-tert-butylphenyl)-3-oxo-3-phenylpropyl]propanedinitrile IUPAC Name: 2-[1-(4-tert-butylphenyl)-3-oxo-3-phenylpropyl]propanedinitrile Traditional Name: 2-[1-(4-tert-butylphenyl)-3-keto-3-phenyl-propyl]malononitrile Formula: C22H22N2O MolecularWeight: 330.42288

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C(CC(=O)C2=CC=CC=C2)C(C#N)C#N

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C(CC(=O)C2=CC=CC=C2)C(C#N)C#N

InChI

InChI=1S/C22H22N2O/c1-22(2,3)19-11-9-16(10-12-19)20(18(14-23)15-24)13-21(25)17-7-5-4-6-8-17/h4-12,18,20H,13H2,1-3H3