N-[(2R,3R,4R,5S,6R)-6-(hydroxymethyl)-2,4,5-tris(oxidanyl)oxan-3-yl]ethanimidate; 4-nitrophenol

Systemtic Name: N-[(2R,3R,4R,5S,6R)-6-(hydroxymethyl)-2,4,5-tris(oxidanyl)oxan-3-yl]ethanimidate; 4-nitrophenol Openeye Name: 4-nitrophenol; N-[(2R,3R,4R,5S,6R)-2,4,5-trihydroxy-6-(hydroxymethyl)tetrahydropyran-3-yl]ethanimidate CAS Name: 4-nitrophenol; N-[(2R,3R,4R,5S,6R)-2,4,5-trihydroxy-6-(hydroxymethyl)-3-oxanyl]ethanimidate IUPAC Name: 4-nitrophenol; N-[(2R,3R,4R,5S,6R)-2,4,5-trihydroxy-6-(hydroxymethyl)oxan-3-yl]ethanimidate Traditional Name: 4-nitrophenol; N-[(2R,3R,4R,5S,6R)-2,4,5-trihydroxy-6-methylol-tetrahydropyran-3-yl]acetimidate Formula: C14H19N2O9- MolecularWeight: 359.30866

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Descriptors Computed from Structure

Canonical SMILES:

CC(=NC1C(C(C(OC1O)CO)O)O)[O-].C1=CC(=CC=C1[N+](=O)[O-])O

Isomeric SMILES

CC(=N[C@@H]1[C@H]([C@@H]([C@H](O[C@H]1O)CO)O)O)[O-].C1=CC(=CC=C1[N+](=O)[O-])O

InChI

InChI=1S/C8H15NO6.C6H5NO3/c1-3(11)9-5-7(13)6(12)4(2-10)15-8(5)14;8-6-3-1-5(2-4-6)7(9)10/h4-8,10,12-14H,2H2,1H3,(H,9,11);1-4,8H/p-1/t4-,5-,6-,7-,8-;/m1./s1