2-(4-bromophenyl)-4-[[(4-chloranyl-2-nitro-phenyl)amino]methylidene]-5-methyl-pyrazol-3-one

Systemtic Name: 2-(4-bromophenyl)-4-[[(4-chloranyl-2-nitro-phenyl)amino]methylidene]-5-methyl-pyrazol-3-one Openeye Name: 2-(4-bromophenyl)-4-[(4-chloro-2-nitro-anilino)methylene]-5-methyl-pyrazol-3-one CAS Name: 2-(4-bromophenyl)-4-[(4-chloro-2-nitroanilino)methylidene]-5-methyl-3-pyrazolone IUPAC Name: 2-(4-bromophenyl)-4-[(4-chloro-2-nitroanilino)methylidene]-5-methylpyrazol-3-one Traditional Name: 2-(4-bromophenyl)-4-[(4-chloro-2-nitro-anilino)methylene]-5-methyl-2-pyrazolin-3-one Formula: C17H12BrClN4O3 MolecularWeight: 435.65918

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H12BrClN4O3/c1-10-14(9-20-15-7-4-12(19)8-16(15)23(25)26)17(24)22(21-10)13-5-2-11(18)3-6-13/h2-9,20H,1H3