2-[3-(2-cyanopropan-2-yl)-5-(2-oxidanylpropan-2-yl)phenyl]-2-methyl-propanenitrile

Systemtic Name: 2-[3-(2-cyanopropan-2-yl)-5-(2-oxidanylpropan-2-yl)phenyl]-2-methyl-propanenitrile Openeye Name: 2-[3-(1-cyano-1-methyl-ethyl)-5-(1-hydroxy-1-methyl-ethyl)phenyl]-2-methyl-propanenitrile CAS Name: 2-[3-(2-cyanopropan-2-yl)-5-(2-hydroxypropan-2-yl)phenyl]-2-methylpropanenitrile IUPAC Name: 2-[3-(2-cyanopropan-2-yl)-5-(2-hydroxypropan-2-yl)phenyl]-2-methylpropanenitrile Traditional Name: 2-[3-(1-cyano-1-methyl-ethyl)-5-(1-hydroxy-1-methyl-ethyl)phenyl]-2-methyl-propionitrile Formula: C17H22N2O MolecularWeight: 270.36938

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H22N2O/c1-15(2,10-18)12-7-13(16(3,4)11-19)9-14(8-12)17(5,6)20/h7-9,20H,1-6H3