S-[(4,7-dimethoxy-6-oxidanyl-1-benzofuran-5-yl)methyl] 3-oxidanylidenebutanethioate

Systemtic Name: S-[(4,7-dimethoxy-6-oxidanyl-1-benzofuran-5-yl)methyl] 3-oxidanylidenebutanethioate Openeye Name: S-[(6-hydroxy-4,7-dimethoxy-benzofuran-5-yl)methyl] 3-oxobutanethioate CAS Name: 3-oxobutanethioic acid S-[(6-hydroxy-4,7-dimethoxy-5-benzofuranyl)methyl] ester IUPAC Name: S-[(6-hydroxy-4,7-dimethoxy-1-benzofuran-5-yl)methyl] 3-oxobutanethioate Traditional Name: 3-ketobutanethioic acid S-[(6-hydroxy-4,7-dimethoxy-benzofuran-5-yl)methyl] ester Formula: C15H16O6S MolecularWeight: 324.34894

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)CC(=O)SCC1=C(C2=C(C(=C1O)OC)OC=C2)OC

Isomeric SMILES

CC(=O)CC(=O)SCC1=C(C2=C(C(=C1O)OC)OC=C2)OC

InChI

InChI=1S/C15H16O6S/c1-8(16)6-11(17)22-7-10-12(18)15(20-3)14-9(4-5-21-14)13(10)19-2/h4-5,18H,6-7H2,1-3H3