dimethyl [1-(4-nitrophenyl)-6-oxidanylidene-pyridazin-3-yl] phosphate

Systemtic Name: dimethyl [1-(4-nitrophenyl)-6-oxidanylidene-pyridazin-3-yl] phosphate Openeye Name: dimethyl [1-(4-nitrophenyl)-6-oxo-pyridazin-3-yl] phosphate CAS Name: phosphoric acid dimethyl [1-(4-nitrophenyl)-6-oxo-3-pyridazinyl] ester IUPAC Name: dimethyl [1-(4-nitrophenyl)-6-oxopyridazin-3-yl] phosphate Traditional Name: phosphoric acid [6-keto-1-(4-nitrophenyl)pyridazin-3-yl] dimethyl ester Formula: C12H12N3O7P MolecularWeight: 341.213341

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Descriptors Computed from Structure

Canonical SMILES:

COP(=O)(OC)OC1=NN(C(=O)C=C1)C2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

COP(=O)(OC)OC1=NN(C(=O)C=C1)C2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C12H12N3O7P/c1-20-23(19,21-2)22-11-7-8-12(16)14(13-11)9-3-5-10(6-4-9)15(17)18/h3-8H,1-2H3