2-[2-(methylamino)-6-[2-(phosphonomethoxy)ethoxy]pyrimidin-4-yl]oxyethoxymethylphosphonic acid

Systemtic Name: 2-[2-(methylamino)-6-[2-(phosphonomethoxy)ethoxy]pyrimidin-4-yl]oxyethoxymethylphosphonic acid Openeye Name: 2-[2-(methylamino)-6-[2-(phosphonomethoxy)ethoxy]pyrimidin-4-yl]oxyethoxymethylphosphonic acid CAS Name: 2-[[2-(methylamino)-6-[2-(phosphonomethoxy)ethoxy]-4-pyrimidinyl]oxy]ethoxymethylphosphonic acid IUPAC Name: 2-[2-(methylamino)-6-[2-(phosphonomethoxy)ethoxy]pyrimidin-4-yl]oxyethoxymethylphosphonic acid Traditional Name: 2-[2-(methylamino)-6-[2-(phosphonomethoxy)ethoxy]pyrimidin-4-yl]oxyethoxymethylphosphonic acid Formula: C11H21N3O10P2 MolecularWeight: 417.246062

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Descriptors Computed from Structure

Canonical SMILES:

CNC1=NC(=CC(=N1)OCCOCP(=O)(O)O)OCCOCP(=O)(O)O

Isomeric SMILES

CNC1=NC(=CC(=N1)OCCOCP(=O)(O)O)OCCOCP(=O)(O)O

InChI

InChI=1S/C11H21N3O10P2/c1-12-11-13-9(23-4-2-21-7-25(15,16)17)6-10(14-11)24-5-3-22-8-26(18,19)20/h6H,2-5,7-8H2,1H3,(H,12,13,14)(H2,15,16,17)(H2,18,19,20)