2-(3-nitrophenyl)-3-oxidanylidene-1H-pyrazole-5-carboxylic acid

Systemtic Name: 2-(3-nitrophenyl)-3-oxidanylidene-1H-pyrazole-5-carboxylic acid Openeye Name: 2-(3-nitrophenyl)-3-oxo-1H-pyrazole-5-carboxylic acid CAS Name: 2-(3-nitrophenyl)-3-oxo-1H-pyrazole-5-carboxylic acid IUPAC Name: 2-(3-nitrophenyl)-3-oxo-1H-pyrazole-5-carboxylic acid Traditional Name: 5-keto-1-(3-nitrophenyl)-3-pyrazoline-3-carboxylic acid Formula: C10H7N3O5 MolecularWeight: 249.17968

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)[N+](=O)[O-])N2C(=O)C=C(N2)C(=O)O

Isomeric SMILES

C1=CC(=CC(=C1)[N+](=O)[O-])N2C(=O)C=C(N2)C(=O)O

InChI

InChI=1S/C10H7N3O5/c14-9-5-8(10(15)16)11-12(9)6-2-1-3-7(4-6)13(17)18/h1-5,11H,(H,15,16)