2-(4-tert-butyl-2-methanoyl-phenyl)ethanenitrile

Systemtic Name: 2-(4-tert-butyl-2-methanoyl-phenyl)ethanenitrile Openeye Name: 2-(4-tert-butyl-2-formyl-phenyl)acetonitrile CAS Name: 2-(4-tert-butyl-2-formylphenyl)acetonitrile IUPAC Name: 2-(4-tert-butyl-2-formylphenyl)acetonitrile Traditional Name: 2-(4-tert-butyl-2-formyl-phenyl)acetonitrile Formula: C13H15NO MolecularWeight: 201.2643

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H15NO/c1-13(2,3)12-5-4-10(6-7-14)11(8-12)9-15/h4-5,8-9H,6H2,1-3H3