4-[[(3-chlorophenyl)amino]methylidene]-2-(4-nitrophenyl)-5-phenyl-pyrazol-3-one

Systemtic Name: 4-[[(3-chlorophenyl)amino]methylidene]-2-(4-nitrophenyl)-5-phenyl-pyrazol-3-one Openeye Name: 4-[(3-chloroanilino)methylene]-2-(4-nitrophenyl)-5-phenyl-pyrazol-3-one CAS Name: 4-[(3-chloroanilino)methylidene]-2-(4-nitrophenyl)-5-phenyl-3-pyrazolone IUPAC Name: 4-[(3-chloroanilino)methylidene]-2-(4-nitrophenyl)-5-phenylpyrazol-3-one Traditional Name: 4-[(3-chloroanilino)methylene]-2-(4-nitrophenyl)-5-phenyl-2-pyrazolin-3-one Formula: C22H15ClN4O3 MolecularWeight: 418.8325

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=NN(C(=O)C2=CNC3=CC(=CC=C3)Cl)C4=CC=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)C2=NN(C(=O)C2=CNC3=CC(=CC=C3)Cl)C4=CC=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C22H15ClN4O3/c23-16-7-4-8-17(13-16)24-14-20-21(15-5-2-1-3-6-15)25-26(22(20)28)18-9-11-19(12-10-18)27(29)30/h1-14,24H