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

Systemtic Name: 2-[3-(2-cyanopropan-2-yl)-5-[oxidanyl(pyridin-3-yl)methyl]phenyl]-2-methyl-propanenitrile Openeye Name: 2-[3-(1-cyano-1-methyl-ethyl)-5-[hydroxy(3-pyridyl)methyl]phenyl]-2-methyl-propanenitrile CAS Name: 2-[3-(2-cyanopropan-2-yl)-5-[hydroxy(3-pyridinyl)methyl]phenyl]-2-methylpropanenitrile IUPAC Name: 2-[3-(2-cyanopropan-2-yl)-5-[hydroxy(pyridin-3-yl)methyl]phenyl]-2-methylpropanenitrile Traditional Name: 2-[3-(1-cyano-1-methyl-ethyl)-5-[hydroxy(3-pyridyl)methyl]phenyl]-2-methyl-propionitrile Formula: C20H21N3O MolecularWeight: 319.40024

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H21N3O/c1-19(2,12-21)16-8-15(9-17(10-16)20(3,4)13-22)18(24)14-6-5-7-23-11-14/h5-11,18,24H,1-4H3