[1-[(2-azanyl-6-oxidanylidene-7,8-dihydro-3H-purin-9-yl)oxy]-3-oxidanyl-propan-2-yl]oxymethylphosphonic acid

Systemtic Name: [1-[(2-azanyl-6-oxidanylidene-7,8-dihydro-3H-purin-9-yl)oxy]-3-oxidanyl-propan-2-yl]oxymethylphosphonic acid Openeye Name: [1-[(2-amino-6-oxo-7,8-dihydro-3H-purin-9-yl)oxymethyl]-2-hydroxy-ethoxy]methylphosphonic acid CAS Name: [1-[(2-amino-6-oxo-7,8-dihydro-3H-purin-9-yl)oxy]-3-hydroxypropan-2-yl]oxymethylphosphonic acid IUPAC Name: [1-[(2-amino-6-oxo-7,8-dihydro-3H-purin-9-yl)oxy]-3-hydroxypropan-2-yl]oxymethylphosphonic acid Traditional Name: [1-[(2-amino-6-keto-7,8-dihydro-3H-purin-9-yl)oxymethyl]-2-hydroxy-ethoxy]methylphosphonic acid Formula: C9H16N5O7P MolecularWeight: 337.226401

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Descriptors Computed from Structure

Canonical SMILES:

C1NC2=C(N1OCC(CO)OCP(=O)(O)O)NC(=NC2=O)N

Isomeric SMILES

C1NC2=C(N1OCC(CO)OCP(=O)(O)O)NC(=NC2=O)N

InChI

InChI=1S/C9H16N5O7P/c10-9-12-7-6(8(16)13-9)11-3-14(7)21-2-5(1-15)20-4-22(17,18)19/h5,11,15H,1-4H2,(H2,17,18,19)(H3,10,12,13,16)