1-(4-azanyl-2-oxidanylidene-pyrimidin-1-yl)but-3-enylphosphonic acid

Systemtic Name: 1-(4-azanyl-2-oxidanylidene-pyrimidin-1-yl)but-3-enylphosphonic acid Openeye Name: 1-(4-amino-2-oxo-pyrimidin-1-yl)but-3-enylphosphonic acid CAS Name: 1-(4-amino-2-oxo-1-pyrimidinyl)but-3-enylphosphonic acid IUPAC Name: 1-(4-amino-2-oxopyrimidin-1-yl)but-3-enylphosphonic acid Traditional Name: 1-(4-amino-2-keto-pyrimidin-1-yl)but-3-enylphosphonic acid Formula: C8H12N3O4P MolecularWeight: 245.172341

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Descriptors Computed from Structure

Canonical SMILES:

C=CCC(N1C=CC(=NC1=O)N)P(=O)(O)O

Isomeric SMILES

C=CCC(N1C=CC(=NC1=O)N)P(=O)(O)O

InChI

InChI=1S/C8H12N3O4P/c1-2-3-7(16(13,14)15)11-5-4-6(9)10-8(11)12/h2,4-5,7H,1,3H2,(H2,9,10,12)(H2,13,14,15)