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

Systemtic Name: 3-(5-methyl-3-phenyl-pyrazol-1-yl)-3-oxidanylidene-propanenitrile Openeye Name: 3-(5-methyl-3-phenyl-pyrazol-1-yl)-3-oxo-propanenitrile CAS Name: 3-(5-methyl-3-phenyl-1-pyrazolyl)-3-oxopropanenitrile IUPAC Name: 3-(5-methyl-3-phenylpyrazol-1-yl)-3-oxopropanenitrile Traditional Name: 3-keto-3-(5-methyl-3-phenyl-pyrazol-1-yl)propionitrile Formula: C13H11N3O MolecularWeight: 225.24594

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NN1C(=O)CC#N)C2=CC=CC=C2

Isomeric SMILES

CC1=CC(=NN1C(=O)CC#N)C2=CC=CC=C2

InChI

InChI=1S/C13H11N3O/c1-10-9-12(11-5-3-2-4-6-11)15-16(10)13(17)7-8-14/h2-6,9H,7H2,1H3