1-[(E)-4-diethoxyphosphoryl-2-oxidanyl-but-3-enyl]-5-methyl-pyrimidine-2,4-dione

Systemtic Name: 1-[(E)-4-diethoxyphosphoryl-2-oxidanyl-but-3-enyl]-5-methyl-pyrimidine-2,4-dione Openeye Name: 1-[(E)-4-diethoxyphosphoryl-2-hydroxy-but-3-enyl]-5-methyl-pyrimidine-2,4-dione CAS Name: 1-[(E)-4-diethoxyphosphoryl-2-hydroxybut-3-enyl]-5-methylpyrimidine-2,4-dione IUPAC Name: 1-[(E)-4-diethoxyphosphoryl-2-hydroxybut-3-enyl]-5-methylpyrimidine-2,4-dione Traditional Name: 1-[(E)-4-diethoxyphosphoryl-2-hydroxy-but-3-enyl]-5-methyl-pyrimidine-2,4-quinone Formula: C13H21N2O6P MolecularWeight: 332.289401

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOP(=O)(C=CC(CN1C=C(C(=O)NC1=O)C)O)OCC

Isomeric SMILES

CCOP(=O)(/C=C/C(CN1C=C(C(=O)NC1=O)C)O)OCC

InChI

InChI=1S/C13H21N2O6P/c1-4-20-22(19,21-5-2)7-6-11(16)9-15-8-10(3)12(17)14-13(15)18/h6-8,11,16H,4-5,9H2,1-3H3,(H,14,17,18)/b7-6+