(5-ethoxycarbonylpyrimidin-4-yl)methylphosphonic acid

Systemtic Name: (5-ethoxycarbonylpyrimidin-4-yl)methylphosphonic acid Openeye Name: (5-ethoxycarbonylpyrimidin-4-yl)methylphosphonic acid CAS Name: (5-ethoxycarbonyl-4-pyrimidinyl)methylphosphonic acid IUPAC Name: (5-ethoxycarbonylpyrimidin-4-yl)methylphosphonic acid Traditional Name: (5-carbethoxypyrimidin-4-yl)methylphosphonic acid Formula: C8H11N2O5P MolecularWeight: 246.157101

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CN=CN=C1CP(=O)(O)O

Isomeric SMILES

CCOC(=O)C1=CN=CN=C1CP(=O)(O)O

InChI

InChI=1S/C8H11N2O5P/c1-2-15-8(11)6-3-9-5-10-7(6)4-16(12,13)14/h3,5H,2,4H2,1H3,(H2,12,13,14)