5-[4-(2-chloranyl-4-nitro-phenoxy)-6-(hydroxymethyl)-3,5-bis(oxidanyl)oxan-2-yl]oxy-6-(hydroxymethyl)oxane-2,3,4-triol

Systemtic Name: 5-[4-(2-chloranyl-4-nitro-phenoxy)-6-(hydroxymethyl)-3,5-bis(oxidanyl)oxan-2-yl]oxy-6-(hydroxymethyl)oxane-2,3,4-triol Openeye Name: 5-[4-(2-chloro-4-nitro-phenoxy)-3,5-dihydroxy-6-(hydroxymethyl)tetrahydropyran-2-yl]oxy-6-(hydroxymethyl)tetrahydropyran-2,3,4-triol CAS Name: 5-[[4-(2-chloro-4-nitrophenoxy)-3,5-dihydroxy-6-(hydroxymethyl)-2-oxanyl]oxy]-6-(hydroxymethyl)oxane-2,3,4-triol IUPAC Name: 5-[4-(2-chloro-4-nitrophenoxy)-3,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-6-(hydroxymethyl)oxane-2,3,4-triol Traditional Name: 5-[4-(2-chloro-4-nitro-phenoxy)-3,5-dihydroxy-6-methylol-tetrahydropyran-2-yl]oxy-6-methylol-tetrahydropyran-2,3,4-triol Formula: C18H24ClNO13 MolecularWeight: 497.83506

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1[N+](=O)[O-])Cl)OC2C(C(OC(C2O)OC3C(OC(C(C3O)O)O)CO)CO)O

Isomeric SMILES

C1=CC(=C(C=C1[N+](=O)[O-])Cl)OC2C(C(OC(C2O)OC3C(OC(C(C3O)O)O)CO)CO)O

InChI

InChI=1S/C18H24ClNO13/c19-7-3-6(20(28)29)1-2-8(7)30-16-11(23)9(4-21)32-18(14(16)26)33-15-10(5-22)31-17(27)13(25)12(15)24/h1-3,9-18,21-27H,4-5H2