2-(hydroxymethyl)-6-[4-(methylamino)phenyl]sulfanyl-oxane-3,4,5-triol

Systemtic Name: 2-(hydroxymethyl)-6-[4-(methylamino)phenyl]sulfanyl-oxane-3,4,5-triol Openeye Name: 2-(hydroxymethyl)-6-[4-(methylamino)phenyl]sulfanyl-tetrahydropyran-3,4,5-triol CAS Name: 2-(hydroxymethyl)-6-[[4-(methylamino)phenyl]thio]oxane-3,4,5-triol IUPAC Name: 2-(hydroxymethyl)-6-[4-(methylamino)phenyl]sulfanyloxane-3,4,5-triol Traditional Name: 2-[[4-(methylamino)phenyl]thio]-6-methylol-tetrahydropyran-3,4,5-triol Formula: C13H19NO5S MolecularWeight: 301.35866

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Descriptors Computed from Structure

Canonical SMILES:

CNC1=CC=C(C=C1)SC2C(C(C(C(O2)CO)O)O)O

Isomeric SMILES

CNC1=CC=C(C=C1)SC2C(C(C(C(O2)CO)O)O)O

InChI

InChI=1S/C13H19NO5S/c1-14-7-2-4-8(5-3-7)20-13-12(18)11(17)10(16)9(6-15)19-13/h2-5,9-18H,6H2,1H3