1-tert-butyl-3-(4-ethylphenyl)pyrazole-4-carbonitrile

Systemtic Name: 1-tert-butyl-3-(4-ethylphenyl)pyrazole-4-carbonitrile Openeye Name: 1-tert-butyl-3-(4-ethylphenyl)pyrazole-4-carbonitrile CAS Name: 1-tert-butyl-3-(4-ethylphenyl)-4-pyrazolecarbonitrile IUPAC Name: 1-tert-butyl-3-(4-ethylphenyl)pyrazole-4-carbonitrile Traditional Name: 1-tert-butyl-3-(4-ethylphenyl)pyrazole-4-carbonitrile Formula: C16H19N3 MolecularWeight: 253.34216

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C2=NN(C=C2C#N)C(C)(C)C

Isomeric SMILES

CCC1=CC=C(C=C1)C2=NN(C=C2C#N)C(C)(C)C

InChI

InChI=1S/C16H19N3/c1-5-12-6-8-13(9-7-12)15-14(10-17)11-19(18-15)16(2,3)4/h6-9,11H,5H2,1-4H3