2-(4-isothiocyanatophenoxy)-4-methoxy-6-methyl-oxane-3,5-diol

Systemtic Name: 2-(4-isothiocyanatophenoxy)-4-methoxy-6-methyl-oxane-3,5-diol Openeye Name: 2-(4-isothiocyanatophenoxy)-4-methoxy-6-methyl-tetrahydropyran-3,5-diol CAS Name: 2-(4-isothiocyanatophenoxy)-4-methoxy-6-methyloxane-3,5-diol IUPAC Name: 2-(4-isothiocyanatophenoxy)-4-methoxy-6-methyloxane-3,5-diol Traditional Name: 2-(4-isothiocyanatophenoxy)-4-methoxy-6-methyl-tetrahydropyran-3,5-diol Formula: C14H17NO5S MolecularWeight: 311.35348

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(C(C(C(O1)OC2=CC=C(C=C2)N=C=S)O)OC)O

Isomeric SMILES

CC1C(C(C(C(O1)OC2=CC=C(C=C2)N=C=S)O)OC)O

InChI

InChI=1S/C14H17NO5S/c1-8-11(16)13(18-2)12(17)14(19-8)20-10-5-3-9(4-6-10)15-7-21/h3-6,8,11-14,16-17H,1-2H3