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

Systemtic Name: 5-(4-chlorophenyl)carbonyl-4,4-bis(oxidanyl)-2-phenyl-pyrazol-3-one Openeye Name: 5-(4-chlorobenzoyl)-4,4-dihydroxy-2-phenyl-pyrazol-3-one CAS Name: 5-[(4-chlorophenyl)-oxomethyl]-4,4-dihydroxy-2-phenyl-3-pyrazolone IUPAC Name: 5-(4-chlorobenzoyl)-4,4-dihydroxy-2-phenylpyrazol-3-one Traditional Name: 5-(4-chlorobenzoyl)-4,4-dihydroxy-2-phenyl-2-pyrazolin-3-one Formula: C16H11ClN2O4 MolecularWeight: 330.72254

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C(=O)C(C(=N2)C(=O)C3=CC=C(C=C3)Cl)(O)O

Isomeric SMILES

C1=CC=C(C=C1)N2C(=O)C(C(=N2)C(=O)C3=CC=C(C=C3)Cl)(O)O

InChI

InChI=1S/C16H11ClN2O4/c17-11-8-6-10(7-9-11)13(20)14-16(22,23)15(21)19(18-14)12-4-2-1-3-5-12/h1-9,22-23H