3-(2-ethanoylphenyl)-2-methyl-propanenitrile

Systemtic Name: 3-(2-ethanoylphenyl)-2-methyl-propanenitrile Openeye Name: 3-(2-acetylphenyl)-2-methyl-propanenitrile CAS Name: 3-(2-acetylphenyl)-2-methylpropanenitrile IUPAC Name: 3-(2-acetylphenyl)-2-methylpropanenitrile Traditional Name: 3-(2-acetylphenyl)-2-methyl-propionitrile Formula: C12H13NO MolecularWeight: 187.23772

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC1=CC=CC=C1C(=O)C)C#N

Isomeric SMILES

CC(CC1=CC=CC=C1C(=O)C)C#N

InChI

InChI=1S/C12H13NO/c1-9(8-13)7-11-5-3-4-6-12(11)10(2)14/h3-6,9H,7H2,1-2H3