2-tert-butyl-4,4-bis(oxidanyl)-5-phenyl-pyrazol-3-one

Systemtic Name: 2-tert-butyl-4,4-bis(oxidanyl)-5-phenyl-pyrazol-3-one Openeye Name: 2-tert-butyl-4,4-dihydroxy-5-phenyl-pyrazol-3-one CAS Name: 2-tert-butyl-4,4-dihydroxy-5-phenyl-3-pyrazolone IUPAC Name: 2-tert-butyl-4,4-dihydroxy-5-phenylpyrazol-3-one Traditional Name: 2-tert-butyl-4,4-dihydroxy-5-phenyl-2-pyrazolin-3-one Formula: C13H16N2O3 MolecularWeight: 248.27774

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)N1C(=O)C(C(=N1)C2=CC=CC=C2)(O)O

Isomeric SMILES

CC(C)(C)N1C(=O)C(C(=N1)C2=CC=CC=C2)(O)O

InChI

InChI=1S/C13H16N2O3/c1-12(2,3)15-11(16)13(17,18)10(14-15)9-7-5-4-6-8-9/h4-8,17-18H,1-3H3