1-[(2R,3R,4S,5S,6R)-6-(azidomethyl)-3,4,5-tris(oxidanyl)oxan-2-yl]-2-ethoxy-5-iodanyl-pyrimidin-4-one

Systemtic Name: 1-[(2R,3R,4S,5S,6R)-6-(azidomethyl)-3,4,5-tris(oxidanyl)oxan-2-yl]-2-ethoxy-5-iodanyl-pyrimidin-4-one Openeye Name: 1-[(2R,3R,4S,5S,6R)-6-(azidomethyl)-3,4,5-trihydroxy-tetrahydropyran-2-yl]-2-ethoxy-5-iodo-pyrimidin-4-one CAS Name: 1-[(2R,3R,4S,5S,6R)-6-(azidomethyl)-3,4,5-trihydroxy-2-oxanyl]-2-ethoxy-5-iodo-4-pyrimidinone IUPAC Name: 1-[(2R,3R,4S,5S,6R)-6-(azidomethyl)-3,4,5-trihydroxyoxan-2-yl]-2-ethoxy-5-iodopyrimidin-4-one Traditional Name: 1-[(2R,3R,4S,5S,6R)-6-(azidomethyl)-3,4,5-trihydroxy-tetrahydropyran-2-yl]-2-ethoxy-5-iodo-pyrimidin-4-one Formula: C12H16IN5O6 MolecularWeight: 453.18981

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=NC(=O)C(=CN1C2C(C(C(C(O2)CN=[N+]=[N-])O)O)O)I

Isomeric SMILES

CCOC1=NC(=O)C(=CN1[C@H]2[C@@H]([C@H]([C@@H]([C@H](O2)CN=[N+]=[N-])O)O)O)I

InChI

InChI=1S/C12H16IN5O6/c1-2-23-12-16-10(22)5(13)4-18(12)11-9(21)8(20)7(19)6(24-11)3-15-17-14/h4,6-9,11,19-21H,2-3H2,1H3/t6-,7-,8+,9-,11-/m1/s1