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

Systemtic Name: 2-(4-chlorophenyl)-5-(3-nitrophenyl)-4,4-bis(oxidanyl)pyrazol-3-one Openeye Name: 2-(4-chlorophenyl)-4,4-dihydroxy-5-(3-nitrophenyl)pyrazol-3-one CAS Name: 2-(4-chlorophenyl)-4,4-dihydroxy-5-(3-nitrophenyl)-3-pyrazolone IUPAC Name: 2-(4-chlorophenyl)-4,4-dihydroxy-5-(3-nitrophenyl)pyrazol-3-one Traditional Name: 2-(4-chlorophenyl)-4,4-dihydroxy-5-(3-nitrophenyl)-2-pyrazolin-3-one Formula: C15H10ClN3O5 MolecularWeight: 347.71

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)[N+](=O)[O-])C2=NN(C(=O)C2(O)O)C3=CC=C(C=C3)Cl

Isomeric SMILES

C1=CC(=CC(=C1)[N+](=O)[O-])C2=NN(C(=O)C2(O)O)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C15H10ClN3O5/c16-10-4-6-11(7-5-10)18-14(20)15(21,22)13(17-18)9-2-1-3-12(8-9)19(23)24/h1-8,21-22H