4-azanyl-1-[(E)-4-diethoxyphosphoryl-2-oxidanyl-but-3-enoxy]pyrimidin-2-one

Systemtic Name: 4-azanyl-1-[(E)-4-diethoxyphosphoryl-2-oxidanyl-but-3-enoxy]pyrimidin-2-one Openeye Name: 4-amino-1-[(E)-4-diethoxyphosphoryl-2-hydroxy-but-3-enoxy]pyrimidin-2-one CAS Name: 4-amino-1-[(E)-4-diethoxyphosphoryl-2-hydroxybut-3-enoxy]-2-pyrimidinone IUPAC Name: 4-amino-1-[(E)-4-diethoxyphosphoryl-2-hydroxybut-3-enoxy]pyrimidin-2-one Traditional Name: 4-amino-1-[(E)-4-diethoxyphosphoryl-2-hydroxy-but-3-enoxy]pyrimidin-2-one Formula: C12H20N3O6P MolecularWeight: 333.277461

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Descriptors Computed from Structure

Canonical SMILES:

CCOP(=O)(C=CC(CON1C=CC(=NC1=O)N)O)OCC

Isomeric SMILES

CCOP(=O)(/C=C/C(CON1C=CC(=NC1=O)N)O)OCC

InChI

InChI=1S/C12H20N3O6P/c1-3-20-22(18,21-4-2)8-6-10(16)9-19-15-7-5-11(13)14-12(15)17/h5-8,10,16H,3-4,9H2,1-2H3,(H2,13,14,17)/b8-6+