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

Systemtic Name: sodium 2-[2-azanyl-6-(2-hydroxyethyloxy)pyrimidin-4-yl]oxyethoxymethyl-(2-hexadecoxyethoxy)phosphinate Openeye Name: sodium 2-[2-amino-6-(2-hydroxyethoxy)pyrimidin-4-yl]oxyethoxymethyl-(2-hexadecoxyethoxy)phosphinate CAS Name: sodium 2-[[2-amino-6-(2-hydroxyethoxy)-4-pyrimidinyl]oxy]ethoxymethyl-(2-hexadecoxyethoxy)phosphinate IUPAC Name: sodium 2-[2-amino-6-(2-hydroxyethoxy)pyrimidin-4-yl]oxyethoxymethyl-(2-hexadecoxyethoxy)phosphinate Traditional Name: sodium 2-[2-amino-6-(2-hydroxyethoxy)pyrimidin-4-yl]oxyethoxymethyl-(2-cetyloxyethoxy)phosphinate Formula: C27H51N3NaO8P MolecularWeight: 599.672671

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCOCCOP(=O)(COCCOC1=NC(=NC(=C1)OCCO)N)[O-].[Na+]

Isomeric SMILES

CCCCCCCCCCCCCCCCOCCOP(=O)(COCCOC1=NC(=NC(=C1)OCCO)N)[O-].[Na+]

InChI

InChI=1S/C27H52N3O8P.Na/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-17-34-20-22-38-39(32,33)24-35-19-21-37-26-23-25(36-18-16-31)29-27(28)30-26;/h23,31H,2-22,24H2,1H3,(H,32,33)(H2,28,29,30);/q;+1/p-1