3-oxidanylidene-3-(3,4,5-trimethylphenyl)propanenitrile

Systemtic Name: 3-oxidanylidene-3-(3,4,5-trimethylphenyl)propanenitrile Openeye Name: 3-oxo-3-(3,4,5-trimethylphenyl)propanenitrile CAS Name: 3-oxo-3-(3,4,5-trimethylphenyl)propanenitrile IUPAC Name: 3-oxo-3-(3,4,5-trimethylphenyl)propanenitrile Traditional Name: 3-keto-3-(3,4,5-trimethylphenyl)propionitrile Formula: C12H13NO MolecularWeight: 187.23772

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H13NO/c1-8-6-11(12(14)4-5-13)7-9(2)10(8)3/h6-7H,4H2,1-3H3