1-oxidanyl-1-[3,4,5-triethanoyl-6-isothiocyanato-3,4,5-tris(oxidanyl)oxan-2-yl]propan-2-one

Systemtic Name: 1-oxidanyl-1-[3,4,5-triethanoyl-6-isothiocyanato-3,4,5-tris(oxidanyl)oxan-2-yl]propan-2-one Openeye Name: 1-hydroxy-1-(3,4,5-triacetyl-3,4,5-trihydroxy-6-isothiocyanato-tetrahydropyran-2-yl)propan-2-one CAS Name: 1-hydroxy-1-(3,4,5-triacetyl-3,4,5-trihydroxy-6-isothiocyanato-2-oxanyl)-2-propanone IUPAC Name: 1-hydroxy-1-(3,4,5-triacetyl-3,4,5-trihydroxy-6-isothiocyanatooxan-2-yl)propan-2-one Traditional Name: 1-hydroxy-1-(3,4,5-triacetyl-3,4,5-trihydroxy-6-isothiocyanato-tetrahydropyran-2-yl)acetone Formula: C15H19NO9S MolecularWeight: 389.37766

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C(C1C(C(C(C(O1)N=C=S)(C(=O)C)O)(C(=O)C)O)(C(=O)C)O)O

Isomeric SMILES

CC(=O)C(C1C(C(C(C(O1)N=C=S)(C(=O)C)O)(C(=O)C)O)(C(=O)C)O)O

InChI

InChI=1S/C15H19NO9S/c1-6(17)10(21)11-13(22,7(2)18)15(24,9(4)20)14(23,8(3)19)12(25-11)16-5-26/h10-12,21-24H,1-4H3