[6-[(3-hexanoyloxy-1-oxidanylidene-3H-2-benzofuran-5-yl)sulfonyl]-3-oxidanylidene-1H-2-benzofuran-1-yl] hexanoate

Systemtic Name: [6-[(3-hexanoyloxy-1-oxidanylidene-3H-2-benzofuran-5-yl)sulfonyl]-3-oxidanylidene-1H-2-benzofuran-1-yl] hexanoate Openeye Name: [6-[(3-hexanoyloxy-1-oxo-3H-isobenzofuran-5-yl)sulfonyl]-3-oxo-1H-isobenzofuran-1-yl] hexanoate CAS Name: hexanoic acid [3-oxo-6-[[1-oxo-3-(1-oxohexoxy)-3H-isobenzofuran-5-yl]sulfonyl]-1H-isobenzofuran-1-yl] ester IUPAC Name: [6-[(3-hexanoyloxy-1-oxo-3H-2-benzofuran-5-yl)sulfonyl]-3-oxo-1H-2-benzofuran-1-yl] hexanoate Traditional Name: hexanoic acid [6-(3-caproyloxy-1-keto-phthalan-5-yl)sulfonyl-3-keto-phthalan-1-yl] ester Formula: C28H30O10S MolecularWeight: 558.5968

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(=O)OC1C2=C(C=CC(=C2)S(=O)(=O)C3=CC4=C(C=C3)C(=O)OC4OC(=O)CCCCC)C(=O)O1

Isomeric SMILES

CCCCCC(=O)OC1C2=C(C=CC(=C2)S(=O)(=O)C3=CC4=C(C=C3)C(=O)OC4OC(=O)CCCCC)C(=O)O1

InChI

InChI=1S/C28H30O10S/c1-3-5-7-9-23(29)35-27-21-15-17(11-13-19(21)25(31)37-27)39(33,34)18-12-14-20-22(16-18)28(38-26(20)32)36-24(30)10-8-6-4-2/h11-16,27-28H,3-10H2,1-2H3