5-(4-tert-butylphenyl)-1H-pyrazole-3-carbonitrile

Systemtic Name: 5-(4-tert-butylphenyl)-1H-pyrazole-3-carbonitrile Openeye Name: 5-(4-tert-butylphenyl)-1H-pyrazole-3-carbonitrile CAS Name: 5-(4-tert-butylphenyl)-1H-pyrazole-3-carbonitrile IUPAC Name: 5-(4-tert-butylphenyl)-1H-pyrazole-3-carbonitrile Traditional Name: 5-(4-tert-butylphenyl)-1H-pyrazole-3-carbonitrile Formula: C14H15N3 MolecularWeight: 225.289

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C2=CC(=NN2)C#N

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C2=CC(=NN2)C#N

InChI

InChI=1S/C14H15N3/c1-14(2,3)11-6-4-10(5-7-11)13-8-12(9-15)16-17-13/h4-8H,1-3H3,(H,16,17)