[(E)-3-(4-azanyl-1-methyl-2-oxidanylidene-pyrimidin-5-yl)oxyprop-1-enyl]phosphonic acid

Systemtic Name: [(E)-3-(4-azanyl-1-methyl-2-oxidanylidene-pyrimidin-5-yl)oxyprop-1-enyl]phosphonic acid Openeye Name: [(E)-3-(4-amino-1-methyl-2-oxo-pyrimidin-5-yl)oxyprop-1-enyl]phosphonic acid CAS Name: [(E)-3-[(4-amino-1-methyl-2-oxo-5-pyrimidinyl)oxy]prop-1-enyl]phosphonic acid IUPAC Name: [(E)-3-(4-amino-1-methyl-2-oxopyrimidin-5-yl)oxyprop-1-enyl]phosphonic acid Traditional Name: [(E)-3-(4-amino-2-keto-1-methyl-pyrimidin-5-yl)oxyprop-1-enyl]phosphonic acid Formula: C8H12N3O5P MolecularWeight: 261.171741

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C(=NC1=O)N)OCC=CP(=O)(O)O

Isomeric SMILES

CN1C=C(C(=NC1=O)N)OC/C=C/P(=O)(O)O

InChI

InChI=1S/C8H12N3O5P/c1-11-5-6(7(9)10-8(11)12)16-3-2-4-17(13,14)15/h2,4-5H,3H2,1H3,(H2,9,10,12)(H2,13,14,15)/b4-2+