4-(diethoxyphosphorylmethyl)-2-phenyl-1H-pyrazol-3-one

Systemtic Name: 4-(diethoxyphosphorylmethyl)-2-phenyl-1H-pyrazol-3-one Openeye Name: 4-(diethoxyphosphorylmethyl)-2-phenyl-1H-pyrazol-3-one CAS Name: 4-(diethoxyphosphorylmethyl)-2-phenyl-1H-pyrazol-3-one IUPAC Name: 4-(diethoxyphosphorylmethyl)-2-phenyl-1H-pyrazol-3-one Traditional Name: 4-(diethoxyphosphorylmethyl)-2-phenyl-3-pyrazolin-3-one Formula: C14H19N2O4P MolecularWeight: 310.285421

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Descriptors Computed from Structure

Canonical SMILES:

CCOP(=O)(CC1=CNN(C1=O)C2=CC=CC=C2)OCC

Isomeric SMILES

CCOP(=O)(CC1=CNN(C1=O)C2=CC=CC=C2)OCC

InChI

InChI=1S/C14H19N2O4P/c1-3-19-21(18,20-4-2)11-12-10-15-16(14(12)17)13-8-6-5-7-9-13/h5-10,15H,3-4,11H2,1-2H3