3-oxidanylidene-3-spiro[1,3-dioxolane-2,4'-2,3-dihydrothiochromene]-6'-yl-propanoic acid

Systemtic Name: 3-oxidanylidene-3-spiro[1,3-dioxolane-2,4'-2,3-dihydrothiochromene]-6'-yl-propanoic acid Openeye Name: 3-oxo-3-spiro[1,3-dioxolane-2,4'-thiochromane]-6'-yl-propanoic acid CAS Name: 3-oxo-3-(6'-spiro[1,3-dioxolane-2,4'-2,3-dihydro-1-benzothiopyran]yl)propanoic acid IUPAC Name: 3-oxo-3-spiro[1,3-dioxolane-2,4'-2,3-dihydrothiochromene]-6'-ylpropanoic acid Traditional Name: 3-keto-3-spiro[1,3-dioxolane-2,4'-thiochroman]-6'-yl-propionic acid Formula: C14H14O5S MolecularWeight: 294.32296

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Descriptors Computed from Structure

Canonical SMILES:

C1CSC2=C(C13OCCO3)C=C(C=C2)C(=O)CC(=O)O

Isomeric SMILES

C1CSC2=C(C13OCCO3)C=C(C=C2)C(=O)CC(=O)O

InChI

InChI=1S/C14H14O5S/c15-11(8-13(16)17)9-1-2-12-10(7-9)14(3-6-20-12)18-4-5-19-14/h1-2,7H,3-6,8H2,(H,16,17)