3-oxidanylidene-2-(4-propan-2-ylphenyl)propanenitrile

Systemtic Name: 3-oxidanylidene-2-(4-propan-2-ylphenyl)propanenitrile Openeye Name: 2-(4-isopropylphenyl)-3-oxo-propanenitrile CAS Name: 3-oxo-2-(4-propan-2-ylphenyl)propanenitrile IUPAC Name: 3-oxo-2-(4-propan-2-ylphenyl)propanenitrile Traditional Name: 3-keto-2-p-cumenyl-propionitrile Formula: C12H13NO MolecularWeight: 187.23772

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H13NO/c1-9(2)10-3-5-11(6-4-10)12(7-13)8-14/h3-6,8-9,12H,1-2H3