6-oxidanylidene-6-(6'-oxidanyl-3-oxidanylidene-spiro[2-benzofuran-1,9'-xanthene]-3'-yl)oxy-hexanoic acid

Systemtic Name: 6-oxidanylidene-6-(6'-oxidanyl-3-oxidanylidene-spiro[2-benzofuran-1,9'-xanthene]-3'-yl)oxy-hexanoic acid Openeye Name: 6-(6'-hydroxy-3-oxo-spiro[isobenzofuran-1,9'-xanthene]-3'-yl)oxy-6-oxo-hexanoic acid CAS Name: 6-[(6'-hydroxy-3-oxo-3'-spiro[isobenzofuran-1,9'-xanthene]yl)oxy]-6-oxohexanoic acid IUPAC Name: 6-(6'-hydroxy-3-oxospiro[2-benzofuran-1,9'-xanthene]-3'-yl)oxy-6-oxohexanoic acid Traditional Name: 6-(6'-hydroxy-3-keto-spiro[phthalan-1,9'-xanthene]-3'-yl)oxy-6-keto-hexanoic acid Formula: C26H20O8 MolecularWeight: 460.4322

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)OC23C4=C(C=C(C=C4)O)OC5=C3C=CC(=C5)OC(=O)CCCCC(=O)O

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)OC23C4=C(C=C(C=C4)O)OC5=C3C=CC(=C5)OC(=O)CCCCC(=O)O

InChI

InChI=1S/C26H20O8/c27-15-9-11-19-21(13-15)33-22-14-16(32-24(30)8-4-3-7-23(28)29)10-12-20(22)26(19)18-6-2-1-5-17(18)25(31)34-26/h1-2,5-6,9-14,27H,3-4,7-8H2,(H,28,29)