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

Systemtic Name: sodium 2-[2-azanyl-5-bromanyl-6-(2-hydroxyethyloxy)pyrimidin-4-yl]oxyethoxymethyl-(2-hexadecoxyethoxy)phosphinate Openeye Name: sodium 2-[2-amino-5-bromo-6-(2-hydroxyethoxy)pyrimidin-4-yl]oxyethoxymethyl-(2-hexadecoxyethoxy)phosphinate CAS Name: sodium 2-[[2-amino-5-bromo-6-(2-hydroxyethoxy)-4-pyrimidinyl]oxy]ethoxymethyl-(2-hexadecoxyethoxy)phosphinate IUPAC Name: sodium 2-[2-amino-5-bromo-6-(2-hydroxyethoxy)pyrimidin-4-yl]oxyethoxymethyl-(2-hexadecoxyethoxy)phosphinate Traditional Name: sodium 2-[2-amino-5-bromo-6-(2-hydroxyethoxy)pyrimidin-4-yl]oxyethoxymethyl-(2-cetyloxyethoxy)phosphinate Formula: C27H50BrN3NaO8P MolecularWeight: 678.568731

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCOCCOP(=O)(COCCOC1=NC(=NC(=C1Br)OCCO)N)[O-].[Na+]

Isomeric SMILES

CCCCCCCCCCCCCCCCOCCOP(=O)(COCCOC1=NC(=NC(=C1Br)OCCO)N)[O-].[Na+]

InChI

InChI=1S/C27H51BrN3O8P.Na/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-17-35-20-22-39-40(33,34)23-36-19-21-38-26-24(28)25(37-18-16-32)30-27(29)31-26;/h32H,2-23H2,1H3,(H,33,34)(H2,29,30,31);/q;+1/p-1