4-(1-diethoxyphosphorylethyl)-1,2-dihydropyrazol-3-one

Systemtic Name: 4-(1-diethoxyphosphorylethyl)-1,2-dihydropyrazol-3-one Openeye Name: 4-(1-diethoxyphosphorylethyl)-1,2-dihydropyrazol-3-one CAS Name: 4-(1-diethoxyphosphorylethyl)-1,2-dihydropyrazol-3-one IUPAC Name: 4-(1-diethoxyphosphorylethyl)-1,2-dihydropyrazol-3-one Traditional Name: 4-(1-diethoxyphosphorylethyl)-3-pyrazolin-3-one Formula: C9H17N2O4P MolecularWeight: 248.216041

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOP(=O)(C(C)C1=CNNC1=O)OCC

Isomeric SMILES

CCOP(=O)(C(C)C1=CNNC1=O)OCC

InChI

InChI=1S/C9H17N2O4P/c1-4-14-16(13,15-5-2)7(3)8-6-10-11-9(8)12/h6-7H,4-5H2,1-3H3,(H2,10,11,12)