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

Systemtic Name: 2-(4-chlorophenyl)-5-methyl-4-[[(3-nitrophenyl)amino]methylidene]pyrazol-3-one Openeye Name: 2-(4-chlorophenyl)-5-methyl-4-[(3-nitroanilino)methylene]pyrazol-3-one CAS Name: 2-(4-chlorophenyl)-5-methyl-4-[(3-nitroanilino)methylidene]-3-pyrazolone IUPAC Name: 2-(4-chlorophenyl)-5-methyl-4-[(3-nitroanilino)methylidene]pyrazol-3-one Traditional Name: 2-(4-chlorophenyl)-5-methyl-4-[(3-nitroanilino)methylene]-2-pyrazolin-3-one Formula: C17H13ClN4O3 MolecularWeight: 356.76312

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=O)C1=CNC2=CC(=CC=C2)[N+](=O)[O-])C3=CC=C(C=C3)Cl

Isomeric SMILES

CC1=NN(C(=O)C1=CNC2=CC(=CC=C2)[N+](=O)[O-])C3=CC=C(C=C3)Cl

InChI

InChI=1S/C17H13ClN4O3/c1-11-16(10-19-13-3-2-4-15(9-13)22(24)25)17(23)21(20-11)14-7-5-12(18)6-8-14/h2-10,19H,1H3