[(2R,3S,5R)-5-(4-azanyl-2-oxidanylidene-pyrimidin-1-yl)-3-oxidanyl-oxolan-2-yl]methoxy-ethoxycarbonyl-phosphinic acid

Systemtic Name: [(2R,3S,5R)-5-(4-azanyl-2-oxidanylidene-pyrimidin-1-yl)-3-oxidanyl-oxolan-2-yl]methoxy-ethoxycarbonyl-phosphinic acid Openeye Name: [(2R,3S,5R)-5-(4-amino-2-oxo-pyrimidin-1-yl)-3-hydroxy-tetrahydrofuran-2-yl]methoxy-ethoxycarbonyl-phosphinic acid CAS Name: [(2R,3S,5R)-5-(4-amino-2-oxo-1-pyrimidinyl)-3-hydroxy-2-oxolanyl]methoxy-ethoxycarbonylphosphinic acid IUPAC Name: [(2R,3S,5R)-5-(4-amino-2-oxopyrimidin-1-yl)-3-hydroxyoxolan-2-yl]methoxy-ethoxycarbonylphosphinic acid Traditional Name: [(2R,3S,5R)-5-(4-amino-2-keto-pyrimidin-1-yl)-3-hydroxy-tetrahydrofuran-2-yl]methoxy-carbethoxy-phosphinic acid Formula: C12H18N3O8P MolecularWeight: 363.260381

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)P(=O)(O)OCC1C(CC(O1)N2C=CC(=NC2=O)N)O

Isomeric SMILES

CCOC(=O)P(=O)(O)OC[C@@H]1[C@H](C[C@@H](O1)N2C=CC(=NC2=O)N)O

InChI

InChI=1S/C12H18N3O8P/c1-2-21-12(18)24(19,20)22-6-8-7(16)5-10(23-8)15-4-3-9(13)14-11(15)17/h3-4,7-8,10,16H,2,5-6H2,1H3,(H,19,20)(H2,13,14,17)/t7-,8+,10+/m0/s1