[1-(4-azanyl-2-oxidanylidene-pyrimidin-1-yl)-4-azido-butan-2-yl]oxymethylphosphonic acid

Systemtic Name: [1-(4-azanyl-2-oxidanylidene-pyrimidin-1-yl)-4-azido-butan-2-yl]oxymethylphosphonic acid Openeye Name: [1-[(4-amino-2-oxo-pyrimidin-1-yl)methyl]-3-azido-propoxy]methylphosphonic acid CAS Name: [1-(4-amino-2-oxo-1-pyrimidinyl)-4-azidobutan-2-yl]oxymethylphosphonic acid IUPAC Name: [1-(4-amino-2-oxopyrimidin-1-yl)-4-azidobutan-2-yl]oxymethylphosphonic acid Traditional Name: [1-[(4-amino-2-keto-pyrimidin-1-yl)methyl]-3-azido-propoxy]methylphosphonic acid Formula: C9H15N6O5P MolecularWeight: 318.226361

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Descriptors Computed from Structure

Canonical SMILES:

C1=CN(C(=O)N=C1N)CC(CCN=[N+]=[N-])OCP(=O)(O)O

Isomeric SMILES

C1=CN(C(=O)N=C1N)CC(CCN=[N+]=[N-])OCP(=O)(O)O

InChI

InChI=1S/C9H15N6O5P/c10-8-2-4-15(9(16)13-8)5-7(1-3-12-14-11)20-6-21(17,18)19/h2,4,7H,1,3,5-6H2,(H2,10,13,16)(H2,17,18,19)