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

Systemtic Name: [(2R,3S,4S,5R)-5-(4-azanyl-2-oxidanylidene-pyrimidin-1-yl)-3-chloranyl-4-oxidanyl-oxolan-2-yl]methyl dihydrogen phosphate Openeye Name: [(2R,3S,4S,5R)-5-(4-amino-2-oxo-pyrimidin-1-yl)-3-chloro-4-hydroxy-tetrahydrofuran-2-yl]methyl dihydrogen phosphate CAS Name: [(2R,3S,4S,5R)-5-(4-amino-2-oxo-1-pyrimidinyl)-3-chloro-4-hydroxy-2-oxolanyl]methyl dihydrogen phosphate IUPAC Name: [(2R,3S,4S,5R)-5-(4-amino-2-oxopyrimidin-1-yl)-3-chloro-4-hydroxyoxolan-2-yl]methyl dihydrogen phosphate Traditional Name: [(2R,3S,4S,5R)-5-(4-amino-2-keto-pyrimidin-1-yl)-3-chloro-4-hydroxy-tetrahydrofuran-2-yl]methyl dihydrogen phosphate Formula: C9H13ClN3O7P MolecularWeight: 341.642181

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Descriptors Computed from Structure

Canonical SMILES:

C1=CN(C(=O)N=C1N)C2C(C(C(O2)COP(=O)(O)O)Cl)O

Isomeric SMILES

C1=CN(C(=O)N=C1N)[C@H]2[C@@H]([C@@H]([C@H](O2)COP(=O)(O)O)Cl)O

InChI

InChI=1S/C9H13ClN3O7P/c10-6-4(3-19-21(16,17)18)20-8(7(6)14)13-2-1-5(11)12-9(13)15/h1-2,4,6-8,14H,3H2,(H2,11,12,15)(H2,16,17,18)/t4-,6-,7-,8-/m1/s1