3-(2,5-dimethylphenyl)-3-oxidanylidene-propanenitrile

Systemtic Name: 3-(2,5-dimethylphenyl)-3-oxidanylidene-propanenitrile Openeye Name: 3-(2,5-dimethylphenyl)-3-oxo-propanenitrile CAS Name: 3-(2,5-dimethylphenyl)-3-oxopropanenitrile IUPAC Name: 3-(2,5-dimethylphenyl)-3-oxopropanenitrile Traditional Name: 3-(2,5-dimethylphenyl)-3-keto-propionitrile Formula: C11H11NO MolecularWeight: 173.21114

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)C(=O)CC#N

Isomeric SMILES

CC1=CC(=C(C=C1)C)C(=O)CC#N

InChI

InChI=1S/C11H11NO/c1-8-3-4-9(2)10(7-8)11(13)5-6-12/h3-4,7H,5H2,1-2H3