2-[1-(3-nitrophenyl)-5-oxidanylidene-4H-pyrazol-3-yl]ethanoate

Systemtic Name: 2-[1-(3-nitrophenyl)-5-oxidanylidene-4H-pyrazol-3-yl]ethanoate Openeye Name: 2-[1-(3-nitrophenyl)-5-oxo-4H-pyrazol-3-yl]acetate CAS Name: 2-[1-(3-nitrophenyl)-5-oxo-4H-pyrazol-3-yl]acetate IUPAC Name: 2-[1-(3-nitrophenyl)-5-oxo-4H-pyrazol-3-yl]acetate Traditional Name: 2-[5-keto-1-(3-nitrophenyl)-2-pyrazolin-3-yl]acetate Formula: C11H8N3O5- MolecularWeight: 262.19832

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Descriptors Computed from Structure

Canonical SMILES:

C1C(=NN(C1=O)C2=CC(=CC=C2)[N+](=O)[O-])CC(=O)[O-]

Isomeric SMILES

C1C(=NN(C1=O)C2=CC(=CC=C2)[N+](=O)[O-])CC(=O)[O-]

InChI

InChI=1S/C11H9N3O5/c15-10-4-7(5-11(16)17)12-13(10)8-2-1-3-9(6-8)14(18)19/h1-3,6H,4-5H2,(H,16,17)/p-1