3-(3,5-ditert-butylpyrazol-1-yl)benzenecarbonitrile

Systemtic Name: 3-(3,5-ditert-butylpyrazol-1-yl)benzenecarbonitrile Openeye Name: 3-(3,5-ditert-butylpyrazol-1-yl)benzonitrile CAS Name: 3-(3,5-ditert-butyl-1-pyrazolyl)benzonitrile IUPAC Name: 3-(3,5-ditert-butylpyrazol-1-yl)benzonitrile Traditional Name: 3-(3,5-ditert-butylpyrazol-1-yl)benzonitrile Formula: C18H23N3 MolecularWeight: 281.39532

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=NN1C2=CC=CC(=C2)C#N)C(C)(C)C

Isomeric SMILES

CC(C)(C)C1=CC(=NN1C2=CC=CC(=C2)C#N)C(C)(C)C

InChI

InChI=1S/C18H23N3/c1-17(2,3)15-11-16(18(4,5)6)21(20-15)14-9-7-8-13(10-14)12-19/h7-11H,1-6H3