(4Z)-4-[(4-bromanyl-3-nitro-phenyl)methylidene]-1-(3-methylphenyl)pyrazolidine-3,5-dione

Systemtic Name: (4Z)-4-[(4-bromanyl-3-nitro-phenyl)methylidene]-1-(3-methylphenyl)pyrazolidine-3,5-dione Openeye Name: (4Z)-4-[(4-bromo-3-nitro-phenyl)methylene]-1-(m-tolyl)pyrazolidine-3,5-dione CAS Name: (4Z)-4-[(4-bromo-3-nitrophenyl)methylidene]-1-(3-methylphenyl)pyrazolidine-3,5-dione IUPAC Name: (4Z)-4-[(4-bromo-3-nitrophenyl)methylidene]-1-(3-methylphenyl)pyrazolidine-3,5-dione Traditional Name: (4Z)-4-(4-bromo-3-nitro-benzylidene)-1-(m-tolyl)pyrazolidine-3,5-quinone Formula: C17H12BrN3O4 MolecularWeight: 402.19888

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)N2C(=O)C(=CC3=CC(=C(C=C3)Br)[N+](=O)[O-])C(=O)N2

Isomeric SMILES

CC1=CC(=CC=C1)N2C(=O)/C(=C\C3=CC(=C(C=C3)Br)[N+](=O)[O-])/C(=O)N2

InChI

InChI=1S/C17H12BrN3O4/c1-10-3-2-4-12(7-10)20-17(23)13(16(22)19-20)8-11-5-6-14(18)15(9-11)21(24)25/h2-9H,1H3,(H,19,22)/b13-8-