3-(4-nitrophenyl)-1H-pyrazole-4,5-dione

Systemtic Name: 3-(4-nitrophenyl)-1H-pyrazole-4,5-dione Openeye Name: 3-(4-nitrophenyl)-1H-pyrazole-4,5-dione CAS Name: 3-(4-nitrophenyl)-1H-pyrazole-4,5-dione IUPAC Name: 3-(4-nitrophenyl)-1H-pyrazole-4,5-dione Traditional Name: 5-(4-nitrophenyl)-2-pyrazoline-3,4-quinone Formula: C9H5N3O4 MolecularWeight: 219.1537

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C2=NNC(=O)C2=O)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC=C1C2=NNC(=O)C2=O)[N+](=O)[O-]

InChI

InChI=1S/C9H5N3O4/c13-8-7(10-11-9(8)14)5-1-3-6(4-2-5)12(15)16/h1-4H,(H,11,13,14)