2-[(3-methyl-5-oxidanylidene-1,2-dihydropyrazol-4-yl)-(4-methylphenyl)methyl]propanedinitrile

Systemtic Name: 2-[(3-methyl-5-oxidanylidene-1,2-dihydropyrazol-4-yl)-(4-methylphenyl)methyl]propanedinitrile Openeye Name: 2-[(3-methyl-5-oxo-1,2-dihydropyrazol-4-yl)-(p-tolyl)methyl]propanedinitrile CAS Name: 2-[(3-methyl-5-oxo-1,2-dihydropyrazol-4-yl)-(4-methylphenyl)methyl]propanedinitrile IUPAC Name: 2-[(3-methyl-5-oxo-1,2-dihydropyrazol-4-yl)-(4-methylphenyl)methyl]propanedinitrile Traditional Name: 2-[(3-keto-5-methyl-3-pyrazolin-4-yl)-(p-tolyl)methyl]malononitrile Formula: C15H14N4O MolecularWeight: 266.29786

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(C2=C(NNC2=O)C)C(C#N)C#N

Isomeric SMILES

CC1=CC=C(C=C1)C(C2=C(NNC2=O)C)C(C#N)C#N

InChI

InChI=1S/C15H14N4O/c1-9-3-5-11(6-4-9)14(12(7-16)8-17)13-10(2)18-19-15(13)20/h3-6,12,14H,1-2H3,(H2,18,19,20)