[(E)-4-(4-azanyl-2-oxidanylidene-pyrimidin-1-yl)oxybut-1-enyl]phosphonic acid

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

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Descriptors Computed from Structure

Canonical SMILES:

C1=CN(C(=O)N=C1N)OCCC=CP(=O)(O)O

Isomeric SMILES

C1=CN(C(=O)N=C1N)OCC/C=C/P(=O)(O)O

InChI

InChI=1S/C8H12N3O5P/c9-7-3-4-11(8(12)10-7)16-5-1-2-6-17(13,14)15/h2-4,6H,1,5H2,(H2,9,10,12)(H2,13,14,15)/b6-2+