4-dimethoxyphosphoryl-2-(4-nitrophenyl)-1H-pyrazol-3-one

Systemtic Name: 4-dimethoxyphosphoryl-2-(4-nitrophenyl)-1H-pyrazol-3-one Openeye Name: 4-dimethoxyphosphoryl-2-(4-nitrophenyl)-1H-pyrazol-3-one CAS Name: 4-dimethoxyphosphoryl-2-(4-nitrophenyl)-1H-pyrazol-3-one IUPAC Name: 4-dimethoxyphosphoryl-2-(4-nitrophenyl)-1H-pyrazol-3-one Traditional Name: 4-dimethoxyphosphoryl-2-(4-nitrophenyl)-3-pyrazolin-3-one Formula: C11H12N3O6P MolecularWeight: 313.203241

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Descriptors Computed from Structure

Canonical SMILES:

COP(=O)(C1=CNN(C1=O)C2=CC=C(C=C2)[N+](=O)[O-])OC

Isomeric SMILES

COP(=O)(C1=CNN(C1=O)C2=CC=C(C=C2)[N+](=O)[O-])OC

InChI

InChI=1S/C11H12N3O6P/c1-19-21(18,20-2)10-7-12-13(11(10)15)8-3-5-9(6-4-8)14(16)17/h3-7,12H,1-2H3