4-azanyl-1-[(E)-4-dimethoxyphosphoryl-2-(hydroxymethyl)but-3-enyl]pyrimidin-2-one

Systemtic Name: 4-azanyl-1-[(E)-4-dimethoxyphosphoryl-2-(hydroxymethyl)but-3-enyl]pyrimidin-2-one Openeye Name: 4-amino-1-[(E)-4-dimethoxyphosphoryl-2-(hydroxymethyl)but-3-enyl]pyrimidin-2-one CAS Name: 4-amino-1-[(E)-4-dimethoxyphosphoryl-2-(hydroxymethyl)but-3-enyl]-2-pyrimidinone IUPAC Name: 4-amino-1-[(E)-4-dimethoxyphosphoryl-2-(hydroxymethyl)but-3-enyl]pyrimidin-2-one Traditional Name: 4-amino-1-[(E)-4-dimethoxyphosphoryl-2-methylol-but-3-enyl]pyrimidin-2-one Formula: C11H18N3O5P MolecularWeight: 303.251481

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COP(=O)(C=CC(CN1C=CC(=NC1=O)N)CO)OC

Isomeric SMILES

COP(=O)(/C=C/C(CN1C=CC(=NC1=O)N)CO)OC

InChI

InChI=1S/C11H18N3O5P/c1-18-20(17,19-2)6-4-9(8-15)7-14-5-3-10(12)13-11(14)16/h3-6,9,15H,7-8H2,1-2H3,(H2,12,13,16)/b6-4+