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

Systemtic Name: 5-(4-methylphenyl)-4,4-bis(oxidanyl)-2-phenyl-pyrazol-3-one Openeye Name: 4,4-dihydroxy-2-phenyl-5-(p-tolyl)pyrazol-3-one CAS Name: 4,4-dihydroxy-5-(4-methylphenyl)-2-phenyl-3-pyrazolone IUPAC Name: 4,4-dihydroxy-5-(4-methylphenyl)-2-phenylpyrazol-3-one Traditional Name: 4,4-dihydroxy-2-phenyl-5-(p-tolyl)-2-pyrazolin-3-one Formula: C16H14N2O3 MolecularWeight: 282.29396

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NN(C(=O)C2(O)O)C3=CC=CC=C3

Isomeric SMILES

CC1=CC=C(C=C1)C2=NN(C(=O)C2(O)O)C3=CC=CC=C3

InChI

InChI=1S/C16H14N2O3/c1-11-7-9-12(10-8-11)14-16(20,21)15(19)18(17-14)13-5-3-2-4-6-13/h2-10,20-21H,1H3