2-(3-tert-butyl-4-oxidanyl-phenyl)-3,3-dimethyl-butanenitrile

Systemtic Name: 2-(3-tert-butyl-4-oxidanyl-phenyl)-3,3-dimethyl-butanenitrile Openeye Name: 2-(3-tert-butyl-4-hydroxy-phenyl)-3,3-dimethyl-butanenitrile CAS Name: 2-(3-tert-butyl-4-hydroxyphenyl)-3,3-dimethylbutanenitrile IUPAC Name: 2-(3-tert-butyl-4-hydroxyphenyl)-3,3-dimethylbutanenitrile Traditional Name: 2-(3-tert-butyl-4-hydroxy-phenyl)-3,3-dimethyl-butyronitrile Formula: C16H23NO MolecularWeight: 245.35992

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H23NO/c1-15(2,3)12-9-11(7-8-14(12)18)13(10-17)16(4,5)6/h7-9,13,18H,1-6H3