(Z)-4-methyl-6-[7-methyl-4-oxidanyl-3-oxidanylidene-6-(3-sulfanylpropoxy)-1H-2-benzofuran-5-yl]hex-4-enoic acid

Systemtic Name: (Z)-4-methyl-6-[7-methyl-4-oxidanyl-3-oxidanylidene-6-(3-sulfanylpropoxy)-1H-2-benzofuran-5-yl]hex-4-enoic acid Openeye Name: (Z)-6-[4-hydroxy-7-methyl-3-oxo-6-(3-sulfanylpropoxy)-1H-isobenzofuran-5-yl]-4-methyl-hex-4-enoic acid CAS Name: (Z)-6-[4-hydroxy-6-(3-mercaptopropoxy)-7-methyl-3-oxo-1H-isobenzofuran-5-yl]-4-methyl-4-hexenoic acid IUPAC Name: (Z)-6-[4-hydroxy-7-methyl-3-oxo-6-(3-sulfanylpropoxy)-1H-2-benzofuran-5-yl]-4-methylhex-4-enoic acid Traditional Name: (Z)-6-[4-hydroxy-3-keto-6-(3-mercaptopropoxy)-7-methyl-phthalan-5-yl]-4-methyl-hex-4-enoic acid Formula: C19H24O6S MolecularWeight: 380.45526

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(C2=C1COC2=O)O)CC=C(C)CCC(=O)O)OCCCS

Isomeric SMILES

CC1=C(C(=C(C2=C1COC2=O)O)C/C=C(/C)\CCC(=O)O)OCCCS

InChI

InChI=1S/C19H24O6S/c1-11(5-7-15(20)21)4-6-13-17(22)16-14(10-25-19(16)23)12(2)18(13)24-8-3-9-26/h4,22,26H,3,5-10H2,1-2H3,(H,20,21)/b11-4-