2-[2-[(4-ethoxyphenyl)methyl]phenoxy]-6-(hydroxymethyl)thiane-3,4,5-triol

Systemtic Name: 2-[2-[(4-ethoxyphenyl)methyl]phenoxy]-6-(hydroxymethyl)thiane-3,4,5-triol Openeye Name: 2-[2-[(4-ethoxyphenyl)methyl]phenoxy]-6-(hydroxymethyl)tetrahydrothiopyran-3,4,5-triol CAS Name: 2-[2-[(4-ethoxyphenyl)methyl]phenoxy]-6-(hydroxymethyl)thiane-3,4,5-triol IUPAC Name: 2-[2-[(4-ethoxyphenyl)methyl]phenoxy]-6-(hydroxymethyl)thiane-3,4,5-triol Traditional Name: 2-[2-(4-ethoxybenzyl)phenoxy]-6-methylol-tetrahydrothiopyran-3,4,5-triol Formula: C21H26O6S MolecularWeight: 406.49254

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)CC2=CC=CC=C2OC3C(C(C(C(S3)CO)O)O)O

Isomeric SMILES

CCOC1=CC=C(C=C1)CC2=CC=CC=C2OC3C(C(C(C(S3)CO)O)O)O

InChI

InChI=1S/C21H26O6S/c1-2-26-15-9-7-13(8-10-15)11-14-5-3-4-6-16(14)27-21-20(25)19(24)18(23)17(12-22)28-21/h3-10,17-25H,2,11-12H2,1H3