2,2-dimethyl-6-[2-(phenylcarbonyl)phenoxy]hexanenitrile

Systemtic Name: 2,2-dimethyl-6-[2-(phenylcarbonyl)phenoxy]hexanenitrile Openeye Name: 6-(2-benzoylphenoxy)-2,2-dimethyl-hexanenitrile CAS Name: 6-(2-benzoylphenoxy)-2,2-dimethylhexanenitrile IUPAC Name: 6-(2-benzoylphenoxy)-2,2-dimethylhexanenitrile Traditional Name: 6-(2-benzoylphenoxy)-2,2-dimethyl-hexanenitrile Formula: C21H23NO2 MolecularWeight: 321.41282

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CCCCOC1=CC=CC=C1C(=O)C2=CC=CC=C2)C#N

Isomeric SMILES

CC(C)(CCCCOC1=CC=CC=C1C(=O)C2=CC=CC=C2)C#N

InChI

InChI=1S/C21H23NO2/c1-21(2,16-22)14-8-9-15-24-19-13-7-6-12-18(19)20(23)17-10-4-3-5-11-17/h3-7,10-13H,8-9,14-15H2,1-2H3