3,3,4-trimethyl-2-(phenylcarbonyl)pent-4-enenitrile

Systemtic Name: 3,3,4-trimethyl-2-(phenylcarbonyl)pent-4-enenitrile Openeye Name: 2-benzoyl-3,3,4-trimethyl-pent-4-enenitrile CAS Name: 2-benzoyl-3,3,4-trimethyl-4-pentenenitrile IUPAC Name: 2-benzoyl-3,3,4-trimethylpent-4-enenitrile Traditional Name: 2-benzoyl-3,3,4-trimethyl-pent-4-enenitrile Formula: C15H17NO MolecularWeight: 227.30158

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H17NO/c1-11(2)15(3,4)13(10-16)14(17)12-8-6-5-7-9-12/h5-9,13H,1H2,2-4H3