3-ethanoyl-1-(4-methylphenyl)pyrazole-4-carbonitrile

Systemtic Name: 3-ethanoyl-1-(4-methylphenyl)pyrazole-4-carbonitrile Openeye Name: 3-acetyl-1-(p-tolyl)pyrazole-4-carbonitrile CAS Name: 3-acetyl-1-(4-methylphenyl)-4-pyrazolecarbonitrile IUPAC Name: 3-acetyl-1-(4-methylphenyl)pyrazole-4-carbonitrile Traditional Name: 3-acetyl-1-(p-tolyl)pyrazole-4-carbonitrile Formula: C13H11N3O MolecularWeight: 225.24594

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2C=C(C(=N2)C(=O)C)C#N

Isomeric SMILES

CC1=CC=C(C=C1)N2C=C(C(=N2)C(=O)C)C#N

InChI

InChI=1S/C13H11N3O/c1-9-3-5-12(6-4-9)16-8-11(7-14)13(15-16)10(2)17/h3-6,8H,1-2H3