2-methyl-2-(3-methyl-5-oxidanylidene-1-phenyl-4H-pyrazol-4-yl)propanenitrile

Systemtic Name: 2-methyl-2-(3-methyl-5-oxidanylidene-1-phenyl-4H-pyrazol-4-yl)propanenitrile Openeye Name: 2-methyl-2-(3-methyl-5-oxo-1-phenyl-4H-pyrazol-4-yl)propanenitrile CAS Name: 2-methyl-2-(3-methyl-5-oxo-1-phenyl-4H-pyrazol-4-yl)propanenitrile IUPAC Name: 2-methyl-2-(3-methyl-5-oxo-1-phenyl-4H-pyrazol-4-yl)propanenitrile Traditional Name: 2-(5-keto-3-methyl-1-phenyl-2-pyrazolin-4-yl)-2-methyl-propionitrile Formula: C14H15N3O MolecularWeight: 241.2884

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=O)C1C(C)(C)C#N)C2=CC=CC=C2

Isomeric SMILES

CC1=NN(C(=O)C1C(C)(C)C#N)C2=CC=CC=C2

InChI

InChI=1S/C14H15N3O/c1-10-12(14(2,3)9-15)13(18)17(16-10)11-7-5-4-6-8-11/h4-8,12H,1-3H3