2-(3-nitropyridin-4-yl)-5-phenyl-4H-pyrazol-3-one

Systemtic Name: 2-(3-nitropyridin-4-yl)-5-phenyl-4H-pyrazol-3-one Openeye Name: 2-(3-nitro-4-pyridyl)-5-phenyl-4H-pyrazol-3-one CAS Name: 2-(3-nitro-4-pyridinyl)-5-phenyl-4H-pyrazol-3-one IUPAC Name: 2-(3-nitropyridin-4-yl)-5-phenyl-4H-pyrazol-3-one Traditional Name: 2-(3-nitro-4-pyridyl)-5-phenyl-2-pyrazolin-3-one Formula: C14H10N4O3 MolecularWeight: 282.2542

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Descriptors Computed from Structure

Canonical SMILES:

C1C(=NN(C1=O)C2=C(C=NC=C2)[N+](=O)[O-])C3=CC=CC=C3

Isomeric SMILES

C1C(=NN(C1=O)C2=C(C=NC=C2)[N+](=O)[O-])C3=CC=CC=C3

InChI

InChI=1S/C14H10N4O3/c19-14-8-11(10-4-2-1-3-5-10)16-17(14)12-6-7-15-9-13(12)18(20)21/h1-7,9H,8H2