[(2S)-1-(4-azanyl-5-fluoranyl-2-oxidanylidene-pyrimidin-1-yl)-3-oxidanyl-propan-2-yl]oxymethyl-(3-hexadecoxypropoxy)phosphinic acid

Systemtic Name: [(2S)-1-(4-azanyl-5-fluoranyl-2-oxidanylidene-pyrimidin-1-yl)-3-oxidanyl-propan-2-yl]oxymethyl-(3-hexadecoxypropoxy)phosphinic acid Openeye Name: [(1S)-1-[(4-amino-5-fluoro-2-oxo-pyrimidin-1-yl)methyl]-2-hydroxy-ethoxy]methyl-(3-hexadecoxypropoxy)phosphinic acid CAS Name: [(2S)-1-(4-amino-5-fluoro-2-oxo-1-pyrimidinyl)-3-hydroxypropan-2-yl]oxymethyl-(3-hexadecoxypropoxy)phosphinic acid IUPAC Name: [(2S)-1-(4-amino-5-fluoro-2-oxopyrimidin-1-yl)-3-hydroxypropan-2-yl]oxymethyl-(3-hexadecoxypropoxy)phosphinic acid Traditional Name: [(1S)-1-[(4-amino-5-fluoro-2-keto-pyrimidin-1-yl)methyl]-2-hydroxy-ethoxy]methyl-(3-cetyloxypropoxy)phosphinic acid Formula: C27H51FN3O7P MolecularWeight: 579.681904

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCOCCCOP(=O)(COC(CN1C=C(C(=NC1=O)N)F)CO)O

Isomeric SMILES

CCCCCCCCCCCCCCCCOCCCOP(=O)(CO[C@@H](CN1C=C(C(=NC1=O)N)F)CO)O

InChI

InChI=1S/C27H51FN3O7P/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-17-36-18-16-19-38-39(34,35)23-37-24(22-32)20-31-21-25(28)26(29)30-27(31)33/h21,24,32H,2-20,22-23H2,1H3,(H,34,35)(H2,29,30,33)/t24-/m0/s1