2-chloranyl-4-nitro-phenol; 6-(hydroxymethyl)-3,4,5-tris(oxidanyl)oxan-2-olate

Systemtic Name: 2-chloranyl-4-nitro-phenol; 6-(hydroxymethyl)-3,4,5-tris(oxidanyl)oxan-2-olate Openeye Name: 2-chloro-4-nitro-phenol; 3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydropyran-2-olate CAS Name: 2-chloro-4-nitrophenol; 3,4,5-trihydroxy-6-(hydroxymethyl)-2-oxanolate IUPAC Name: 2-chloro-4-nitrophenol; 3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-olate Traditional Name: 2-chloro-4-nitro-phenol; 3,4,5-trihydroxy-6-methylol-tetrahydropyran-2-olate Formula: C12H15ClNO9- MolecularWeight: 352.7018

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1[N+](=O)[O-])Cl)O.C(C1C(C(C(C(O1)[O-])O)O)O)O

Isomeric SMILES

C1=CC(=C(C=C1[N+](=O)[O-])Cl)O.C(C1C(C(C(C(O1)[O-])O)O)O)O

InChI

InChI=1S/C6H4ClNO3.C6H11O6/c7-5-3-4(8(10)11)1-2-6(5)9;7-1-2-3(8)4(9)5(10)6(11)12-2/h1-3,9H;2-10H,1H2/q;-1