4-[[2-(2-ethanoylsulfanylethyl)-4,6,7-trimethyl-2,3-dihydro-1-benzofuran-5-yl]oxy]-4-oxidanylidene-butanoic acid

Systemtic Name: 4-[[2-(2-ethanoylsulfanylethyl)-4,6,7-trimethyl-2,3-dihydro-1-benzofuran-5-yl]oxy]-4-oxidanylidene-butanoic acid Openeye Name: 4-[[2-(2-acetylsulfanylethyl)-4,6,7-trimethyl-2,3-dihydrobenzofuran-5-yl]oxy]-4-oxo-butanoic acid CAS Name: 4-[[2-[2-(acetylthio)ethyl]-4,6,7-trimethyl-2,3-dihydrobenzofuran-5-yl]oxy]-4-oxobutanoic acid IUPAC Name: 4-[[2-(2-acetylsulfanylethyl)-4,6,7-trimethyl-2,3-dihydro-1-benzofuran-5-yl]oxy]-4-oxobutanoic acid Traditional Name: 4-[2-[2-(acetylthio)ethyl]-4,6,7-trimethyl-coumaran-5-yl]oxy-4-keto-butyric acid Formula: C19H24O6S MolecularWeight: 380.45526

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=C(C(=C1C)OC(=O)CCC(=O)O)C)CC(O2)CCSC(=O)C

Isomeric SMILES

CC1=C2C(=C(C(=C1C)OC(=O)CCC(=O)O)C)CC(O2)CCSC(=O)C

InChI

InChI=1S/C19H24O6S/c1-10-11(2)19-15(9-14(24-19)7-8-26-13(4)20)12(3)18(10)25-17(23)6-5-16(21)22/h14H,5-9H2,1-4H3,(H,21,22)