sodium 2-[2-azanyl-6-(2-hydroxyethyloxy)-5-methyl-pyrimidin-4-yl]oxyethoxymethyl-(2-hexadecoxyethoxy)phosphinate

Systemtic Name: sodium 2-[2-azanyl-6-(2-hydroxyethyloxy)-5-methyl-pyrimidin-4-yl]oxyethoxymethyl-(2-hexadecoxyethoxy)phosphinate Openeye Name: sodium 2-[2-amino-6-(2-hydroxyethoxy)-5-methyl-pyrimidin-4-yl]oxyethoxymethyl-(2-hexadecoxyethoxy)phosphinate CAS Name: sodium 2-[[2-amino-6-(2-hydroxyethoxy)-5-methyl-4-pyrimidinyl]oxy]ethoxymethyl-(2-hexadecoxyethoxy)phosphinate IUPAC Name: sodium 2-[2-amino-6-(2-hydroxyethoxy)-5-methylpyrimidin-4-yl]oxyethoxymethyl-(2-hexadecoxyethoxy)phosphinate Traditional Name: sodium 2-[2-amino-6-(2-hydroxyethoxy)-5-methyl-pyrimidin-4-yl]oxyethoxymethyl-(2-cetyloxyethoxy)phosphinate Formula: C28H53N3NaO8P MolecularWeight: 613.699251

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCOCCOP(=O)(COCCOC1=NC(=NC(=C1C)OCCO)N)[O-].[Na+]

Isomeric SMILES

CCCCCCCCCCCCCCCCOCCOP(=O)(COCCOC1=NC(=NC(=C1C)OCCO)N)[O-].[Na+]

InChI

InChI=1S/C28H54N3O8P.Na/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-18-35-21-23-39-40(33,34)24-36-20-22-38-27-25(2)26(37-19-17-32)30-28(29)31-27;/h32H,3-24H2,1-2H3,(H,33,34)(H2,29,30,31);/q;+1/p-1