4-dimethoxyphosphoryl-2-(phenylmethyl)-1H-pyrazol-5-one

Systemtic Name: 4-dimethoxyphosphoryl-2-(phenylmethyl)-1H-pyrazol-5-one Openeye Name: 2-benzyl-4-dimethoxyphosphoryl-1H-pyrazol-5-one CAS Name: 4-dimethoxyphosphoryl-2-(phenylmethyl)-1H-pyrazol-5-one IUPAC Name: 2-benzyl-4-dimethoxyphosphoryl-1H-pyrazol-5-one Traditional Name: 1-benzyl-4-dimethoxyphosphoryl-3-pyrazolin-3-one Formula: C12H15N2O4P MolecularWeight: 282.232261

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Descriptors Computed from Structure

Canonical SMILES:

COP(=O)(C1=CN(NC1=O)CC2=CC=CC=C2)OC

Isomeric SMILES

COP(=O)(C1=CN(NC1=O)CC2=CC=CC=C2)OC

InChI

InChI=1S/C12H15N2O4P/c1-17-19(16,18-2)11-9-14(13-12(11)15)8-10-6-4-3-5-7-10/h3-7,9H,8H2,1-2H3,(H,13,15)