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

Systemtic Name: (4E)-4-[[(4-azanyl-3-nitro-phenyl)amino]methylidene]-2-(4-bromophenyl)-5-methyl-pyrazol-3-one Openeye Name: (4E)-4-[(4-amino-3-nitro-anilino)methylene]-2-(4-bromophenyl)-5-methyl-pyrazol-3-one CAS Name: (4E)-4-[(4-amino-3-nitroanilino)methylidene]-2-(4-bromophenyl)-5-methyl-3-pyrazolone IUPAC Name: (4E)-4-[(4-amino-3-nitroanilino)methylidene]-2-(4-bromophenyl)-5-methylpyrazol-3-one Traditional Name: (4E)-4-[(4-amino-3-nitro-anilino)methylene]-2-(4-bromophenyl)-5-methyl-2-pyrazolin-3-one Formula: C17H14BrN5O3 MolecularWeight: 416.22876

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CC\1=NN(C(=O)/C1=C/NC2=CC(=C(C=C2)N)[N+](=O)[O-])C3=CC=C(C=C3)Br

InChI

InChI=1S/C17H14BrN5O3/c1-10-14(9-20-12-4-7-15(19)16(8-12)23(25)26)17(24)22(21-10)13-5-2-11(18)3-6-13/h2-9,20H,19H2,1H3/b14-9+