2-[(4-azanyl-2-oxidanylidene-pyrimidin-1-yl)methyl]prop-2-enoxymethylphosphonic acid

Systemtic Name: 2-[(4-azanyl-2-oxidanylidene-pyrimidin-1-yl)methyl]prop-2-enoxymethylphosphonic acid Openeye Name: 2-[(4-amino-2-oxo-pyrimidin-1-yl)methyl]allyloxymethylphosphonic acid CAS Name: 2-[(4-amino-2-oxo-1-pyrimidinyl)methyl]prop-2-enoxymethylphosphonic acid IUPAC Name: 2-[(4-amino-2-oxopyrimidin-1-yl)methyl]prop-2-enoxymethylphosphonic acid Traditional Name: 2-[(4-amino-2-keto-pyrimidin-1-yl)methyl]allyloxymethylphosphonic acid Formula: C9H14N3O5P MolecularWeight: 275.198321

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Descriptors Computed from Structure

Canonical SMILES:

C=C(CN1C=CC(=NC1=O)N)COCP(=O)(O)O

Isomeric SMILES

C=C(CN1C=CC(=NC1=O)N)COCP(=O)(O)O

InChI

InChI=1S/C9H14N3O5P/c1-7(5-17-6-18(14,15)16)4-12-3-2-8(10)11-9(12)13/h2-3H,1,4-6H2,(H2,10,11,13)(H2,14,15,16)