[(2S)-1-(4-azanyl-2-oxidanylidene-pyrimidin-1-yl)-3-oxidanyl-propan-2-yl]oxymethyl-dodecoxy-phosphinic acid

Systemtic Name: [(2S)-1-(4-azanyl-2-oxidanylidene-pyrimidin-1-yl)-3-oxidanyl-propan-2-yl]oxymethyl-dodecoxy-phosphinic acid Openeye Name: [(1S)-1-[(4-amino-2-oxo-pyrimidin-1-yl)methyl]-2-hydroxy-ethoxy]methyl-dodecoxy-phosphinic acid CAS Name: [(2S)-1-(4-amino-2-oxo-1-pyrimidinyl)-3-hydroxypropan-2-yl]oxymethyl-dodecoxyphosphinic acid IUPAC Name: [(2S)-1-(4-amino-2-oxopyrimidin-1-yl)-3-hydroxypropan-2-yl]oxymethyl-dodecoxyphosphinic acid Traditional Name: [(1S)-1-[(4-amino-2-keto-pyrimidin-1-yl)methyl]-2-hydroxy-ethoxy]methyl-lauryloxy-phosphinic acid Formula: C20H38N3O6P MolecularWeight: 447.505981

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCOP(=O)(COC(CN1C=CC(=NC1=O)N)CO)O

Isomeric SMILES

CCCCCCCCCCCCOP(=O)(CO[C@@H](CN1C=CC(=NC1=O)N)CO)O

InChI

InChI=1S/C20H38N3O6P/c1-2-3-4-5-6-7-8-9-10-11-14-29-30(26,27)17-28-18(16-24)15-23-13-12-19(21)22-20(23)25/h12-13,18,24H,2-11,14-17H2,1H3,(H,26,27)(H2,21,22,25)/t18-/m0/s1