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

Systemtic Name: 2-(4-chlorophenyl)-5-(3-methoxyphenyl)-4,4-bis(oxidanyl)pyrazol-3-one Openeye Name: 2-(4-chlorophenyl)-4,4-dihydroxy-5-(3-methoxyphenyl)pyrazol-3-one CAS Name: 2-(4-chlorophenyl)-4,4-dihydroxy-5-(3-methoxyphenyl)-3-pyrazolone IUPAC Name: 2-(4-chlorophenyl)-4,4-dihydroxy-5-(3-methoxyphenyl)pyrazol-3-one Traditional Name: 2-(4-chlorophenyl)-4,4-dihydroxy-5-(3-methoxyphenyl)-2-pyrazolin-3-one Formula: C16H13ClN2O4 MolecularWeight: 332.73842

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)C2=NN(C(=O)C2(O)O)C3=CC=C(C=C3)Cl

Isomeric SMILES

COC1=CC=CC(=C1)C2=NN(C(=O)C2(O)O)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C16H13ClN2O4/c1-23-13-4-2-3-10(9-13)14-16(21,22)15(20)19(18-14)12-7-5-11(17)6-8-12/h2-9,21-22H,1H3