[3-oxidanylidene-4-[(1-oxidanylidene-3-pentanoyloxy-3H-2-benzofuran-4-yl)sulfonyl]-1H-2-benzofuran-1-yl] pentanoate

Systemtic Name: [3-oxidanylidene-4-[(1-oxidanylidene-3-pentanoyloxy-3H-2-benzofuran-4-yl)sulfonyl]-1H-2-benzofuran-1-yl] pentanoate Openeye Name: [3-oxo-4-[(1-oxo-3-pentanoyloxy-3H-isobenzofuran-4-yl)sulfonyl]-1H-isobenzofuran-1-yl] pentanoate CAS Name: pentanoic acid [3-oxo-4-[[1-oxo-3-(1-oxopentoxy)-3H-isobenzofuran-4-yl]sulfonyl]-1H-isobenzofuran-1-yl] ester IUPAC Name: [3-oxo-4-[(1-oxo-3-pentanoyloxy-3H-2-benzofuran-4-yl)sulfonyl]-1H-2-benzofuran-1-yl] pentanoate Traditional Name: valeric acid [3-keto-4-(1-keto-3-valeryloxy-phthalan-4-yl)sulfonyl-phthalan-1-yl] ester Formula: C26H26O10S MolecularWeight: 530.54364

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(=O)OC1C2=C(C(=CC=C2)S(=O)(=O)C3=CC=CC4=C3C(OC4=O)OC(=O)CCCC)C(=O)O1

Isomeric SMILES

CCCCC(=O)OC1C2=C(C(=CC=C2)S(=O)(=O)C3=CC=CC4=C3C(OC4=O)OC(=O)CCCC)C(=O)O1

InChI

InChI=1S/C26H26O10S/c1-3-5-13-19(27)33-25-16-10-8-11-17(21(16)24(30)36-25)37(31,32)18-12-7-9-15-22(18)26(35-23(15)29)34-20(28)14-6-4-2/h7-12,25-26H,3-6,13-14H2,1-2H3