1-[5-tert-butyl-2-(phenylmethyl)pyrazol-3-yl]ethanone

Systemtic Name: 1-[5-tert-butyl-2-(phenylmethyl)pyrazol-3-yl]ethanone Openeye Name: 1-(2-benzyl-5-tert-butyl-pyrazol-3-yl)ethanone CAS Name: 1-[5-tert-butyl-2-(phenylmethyl)-3-pyrazolyl]ethanone IUPAC Name: 1-(2-benzyl-5-tert-butylpyrazol-3-yl)ethanone Traditional Name: 1-(2-benzyl-5-tert-butyl-pyrazol-3-yl)ethanone Formula: C16H20N2O MolecularWeight: 256.3428

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC(=NN1CC2=CC=CC=C2)C(C)(C)C

Isomeric SMILES

CC(=O)C1=CC(=NN1CC2=CC=CC=C2)C(C)(C)C

InChI

InChI=1S/C16H20N2O/c1-12(19)14-10-15(16(2,3)4)17-18(14)11-13-8-6-5-7-9-13/h5-10H,11H2,1-4H3