1-(5-tert-butyl-5-oxidanyl-4H-pyrazol-1-yl)ethanone

Systemtic Name: 1-(5-tert-butyl-5-oxidanyl-4H-pyrazol-1-yl)ethanone Openeye Name: 1-(5-tert-butyl-5-hydroxy-4H-pyrazol-1-yl)ethanone CAS Name: 1-(5-tert-butyl-5-hydroxy-4H-pyrazol-1-yl)ethanone IUPAC Name: 1-(5-tert-butyl-5-hydroxy-4H-pyrazol-1-yl)ethanone Traditional Name: 1-(5-tert-butyl-5-hydroxy-2-pyrazolin-1-yl)ethanone Formula: C9H16N2O2 MolecularWeight: 184.23554

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1C(CC=N1)(C(C)(C)C)O

Isomeric SMILES

CC(=O)N1C(CC=N1)(C(C)(C)C)O

InChI

InChI=1S/C9H16N2O2/c1-7(12)11-9(13,5-6-10-11)8(2,3)4/h6,13H,5H2,1-4H3