4,4-bis(oxidanyl)-5-phenyl-2-propan-2-yl-pyrazol-3-one

Systemtic Name: 4,4-bis(oxidanyl)-5-phenyl-2-propan-2-yl-pyrazol-3-one Openeye Name: 4,4-dihydroxy-2-isopropyl-5-phenyl-pyrazol-3-one CAS Name: 4,4-dihydroxy-5-phenyl-2-propan-2-yl-3-pyrazolone IUPAC Name: 4,4-dihydroxy-5-phenyl-2-propan-2-ylpyrazol-3-one Traditional Name: 4,4-dihydroxy-2-isopropyl-5-phenyl-2-pyrazolin-3-one Formula: C12H14N2O3 MolecularWeight: 234.25116

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H14N2O3/c1-8(2)14-11(15)12(16,17)10(13-14)9-6-4-3-5-7-9/h3-8,16-17H,1-2H3