3-[2,4-dimethoxy-3,6-bis(oxidanyl)phenyl]sulfanylpropanoic acid

Systemtic Name: 3-[2,4-dimethoxy-3,6-bis(oxidanyl)phenyl]sulfanylpropanoic acid Openeye Name: 3-(3,6-dihydroxy-2,4-dimethoxy-phenyl)sulfanylpropanoic acid CAS Name: 3-[(3,6-dihydroxy-2,4-dimethoxyphenyl)thio]propanoic acid IUPAC Name: 3-(3,6-dihydroxy-2,4-dimethoxyphenyl)sulfanylpropanoic acid Traditional Name: 3-[(3,6-dihydroxy-2,4-dimethoxy-phenyl)thio]propionic acid Formula: C11H14O6S MolecularWeight: 274.29026

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C(=C1O)OC)SCCC(=O)O)O

Isomeric SMILES

COC1=CC(=C(C(=C1O)OC)SCCC(=O)O)O

InChI

InChI=1S/C11H14O6S/c1-16-7-5-6(12)11(10(17-2)9(7)15)18-4-3-8(13)14/h5,12,15H,3-4H2,1-2H3,(H,13,14)