2-[2-(2-azanyl-6-oxidanylidene-3H-purin-9-yl)ethoxy]propan-2-ylphosphonic acid

Systemtic Name: 2-[2-(2-azanyl-6-oxidanylidene-3H-purin-9-yl)ethoxy]propan-2-ylphosphonic acid Openeye Name: [1-[2-(2-amino-6-oxo-3H-purin-9-yl)ethoxy]-1-methyl-ethyl]phosphonic acid CAS Name: 2-[2-(2-amino-6-oxo-3H-purin-9-yl)ethoxy]propan-2-ylphosphonic acid IUPAC Name: 2-[2-(2-amino-6-oxo-3H-purin-9-yl)ethoxy]propan-2-ylphosphonic acid Traditional Name: [1-[2-(2-amino-6-keto-3H-purin-9-yl)ethoxy]-1-methyl-ethyl]phosphonic acid Formula: C10H16N5O5P MolecularWeight: 317.238301

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(OCCN1C=NC2=C1NC(=NC2=O)N)P(=O)(O)O

Isomeric SMILES

CC(C)(OCCN1C=NC2=C1NC(=NC2=O)N)P(=O)(O)O

InChI

InChI=1S/C10H16N5O5P/c1-10(2,21(17,18)19)20-4-3-15-5-12-6-7(15)13-9(11)14-8(6)16/h5H,3-4H2,1-2H3,(H2,17,18,19)(H3,11,13,14,16)