3-(4-ethylphenyl)-2-methyl-3-oxidanylidene-propanenitrile

Systemtic Name: 3-(4-ethylphenyl)-2-methyl-3-oxidanylidene-propanenitrile Openeye Name: 3-(4-ethylphenyl)-2-methyl-3-oxo-propanenitrile CAS Name: 3-(4-ethylphenyl)-2-methyl-3-oxopropanenitrile IUPAC Name: 3-(4-ethylphenyl)-2-methyl-3-oxopropanenitrile Traditional Name: 3-(4-ethylphenyl)-3-keto-2-methyl-propionitrile Formula: C12H13NO MolecularWeight: 187.23772

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C(=O)C(C)C#N

Isomeric SMILES

CCC1=CC=C(C=C1)C(=O)C(C)C#N

InChI

InChI=1S/C12H13NO/c1-3-10-4-6-11(7-5-10)12(14)9(2)8-13/h4-7,9H,3H2,1-2H3