sodium [(2S)-1-(4-azanyl-2-oxidanylidene-pyrimidin-1-yl)-3-oxidanyl-propan-2-yl]oxymethyl-[3-(15-methylhexadecoxy)propoxy]phosphinate

Systemtic Name: sodium [(2S)-1-(4-azanyl-2-oxidanylidene-pyrimidin-1-yl)-3-oxidanyl-propan-2-yl]oxymethyl-[3-(15-methylhexadecoxy)propoxy]phosphinate Openeye Name: sodium [(1S)-1-[(4-amino-2-oxo-pyrimidin-1-yl)methyl]-2-hydroxy-ethoxy]methyl-[3-(15-methylhexadecoxy)propoxy]phosphinate CAS Name: sodium [(2S)-1-(4-amino-2-oxo-1-pyrimidinyl)-3-hydroxypropan-2-yl]oxymethyl-[3-(15-methylhexadecoxy)propoxy]phosphinate IUPAC Name: sodium [(2S)-1-(4-amino-2-oxopyrimidin-1-yl)-3-hydroxypropan-2-yl]oxymethyl-[3-(15-methylhexadecoxy)propoxy]phosphinate Traditional Name: sodium [(1S)-1-[(4-amino-2-keto-pyrimidin-1-yl)methyl]-2-hydroxy-ethoxy]methyl-[3-(15-methylhexadecoxy)propoxy]phosphinate Formula: C28H53N3NaO7P MolecularWeight: 597.699851

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCCCCCCCCCCCCCOCCCOP(=O)(COC(CN1C=CC(=NC1=O)N)CO)[O-].[Na+]

Isomeric SMILES

CC(C)CCCCCCCCCCCCCCOCCCOP(=O)(CO[C@@H](CN1C=CC(=NC1=O)N)CO)[O-].[Na+]

InChI

InChI=1S/C28H54N3O7P.Na/c1-25(2)16-13-11-9-7-5-3-4-6-8-10-12-14-19-36-20-15-21-38-39(34,35)24-37-26(23-32)22-31-18-17-27(29)30-28(31)33;/h17-18,25-26,32H,3-16,19-24H2,1-2H3,(H,34,35)(H2,29,30,33);/q;+1/p-1/t26-;/m0./s1