[(2R,3R,4S,5R)-5-[4-azanyl-5-(4-nitrophenyl)-2-oxidanylidene-pyrimidin-1-yl]-4-fluoranyl-3-oxidanyl-oxolan-2-yl]methyl dihydrogen phosphate

Systemtic Name: [(2R,3R,4S,5R)-5-[4-azanyl-5-(4-nitrophenyl)-2-oxidanylidene-pyrimidin-1-yl]-4-fluoranyl-3-oxidanyl-oxolan-2-yl]methyl dihydrogen phosphate Openeye Name: [(2R,3R,4S,5R)-5-[4-amino-5-(4-nitrophenyl)-2-oxo-pyrimidin-1-yl]-4-fluoro-3-hydroxy-tetrahydrofuran-2-yl]methyl dihydrogen phosphate CAS Name: [(2R,3R,4S,5R)-5-[4-amino-5-(4-nitrophenyl)-2-oxo-1-pyrimidinyl]-4-fluoro-3-hydroxy-2-oxolanyl]methyl dihydrogen phosphate IUPAC Name: [(2R,3R,4S,5R)-5-[4-amino-5-(4-nitrophenyl)-2-oxopyrimidin-1-yl]-4-fluoro-3-hydroxyoxolan-2-yl]methyl dihydrogen phosphate Traditional Name: [(2R,3R,4S,5R)-5-[4-amino-2-keto-5-(4-nitrophenyl)pyrimidin-1-yl]-4-fluoro-3-hydroxy-tetrahydrofuran-2-yl]methyl dihydrogen phosphate Formula: C15H16FN4O9P MolecularWeight: 446.281104

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C2=CN(C(=O)N=C2N)C3C(C(C(O3)COP(=O)(O)O)O)F)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC=C1C2=CN(C(=O)N=C2N)[C@H]3[C@H]([C@@H]([C@H](O3)COP(=O)(O)O)O)F)[N+](=O)[O-]

InChI

InChI=1S/C15H16FN4O9P/c16-11-12(21)10(6-28-30(25,26)27)29-14(11)19-5-9(13(17)18-15(19)22)7-1-3-8(4-2-7)20(23)24/h1-5,10-12,14,21H,6H2,(H2,17,18,22)(H2,25,26,27)/t10-,11+,12-,14-/m1/s1