1-[5,5-bis(diethoxyphosphoryl)-1,4-dihydropyrazol-3-yl]propan-1-one

Systemtic Name: 1-[5,5-bis(diethoxyphosphoryl)-1,4-dihydropyrazol-3-yl]propan-1-one Openeye Name: 1-[5,5-bis(diethoxyphosphoryl)-1,4-dihydropyrazol-3-yl]propan-1-one CAS Name: 1-[5,5-bis(diethoxyphosphoryl)-1,4-dihydropyrazol-3-yl]-1-propanone IUPAC Name: 1-[5,5-bis(diethoxyphosphoryl)-1,4-dihydropyrazol-3-yl]propan-1-one Traditional Name: 1-[5,5-bis(diethoxyphosphoryl)-2-pyrazolin-3-yl]propan-1-one Formula: C14H28N2O7P2 MolecularWeight: 398.328842

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)C1=NNC(C1)(P(=O)(OCC)OCC)P(=O)(OCC)OCC

Isomeric SMILES

CCC(=O)C1=NNC(C1)(P(=O)(OCC)OCC)P(=O)(OCC)OCC

InChI

InChI=1S/C14H28N2O7P2/c1-6-13(17)12-11-14(16-15-12,24(18,20-7-2)21-8-3)25(19,22-9-4)23-10-5/h16H,6-11H2,1-5H3