2-(5,8-dimethoxy-4-oxidanylidene-2,3-dihydrothiochromen-2-yl)ethanoic acid

Systemtic Name: 2-(5,8-dimethoxy-4-oxidanylidene-2,3-dihydrothiochromen-2-yl)ethanoic acid Openeye Name: 2-(5,8-dimethoxy-4-oxo-thiochroman-2-yl)acetic acid CAS Name: 2-(5,8-dimethoxy-4-oxo-2,3-dihydro-1-benzothiopyran-2-yl)acetic acid IUPAC Name: 2-(5,8-dimethoxy-4-oxo-2,3-dihydrothiochromen-2-yl)acetic acid Traditional Name: 2-(4-keto-5,8-dimethoxy-thiochroman-2-yl)acetic acid Formula: C13H14O5S MolecularWeight: 282.31226

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C2C(=O)CC(SC2=C(C=C1)OC)CC(=O)O

Isomeric SMILES

COC1=C2C(=O)CC(SC2=C(C=C1)OC)CC(=O)O

InChI

InChI=1S/C13H14O5S/c1-17-9-3-4-10(18-2)13-12(9)8(14)5-7(19-13)6-11(15)16/h3-4,7H,5-6H2,1-2H3,(H,15,16)