3',6'-diacetyloxy-3-oxidanylidene-spiro[2-benzofuran-1,9'-xanthene]-5-carboxylate

Systemtic Name: 3',6'-diacetyloxy-3-oxidanylidene-spiro[2-benzofuran-1,9'-xanthene]-5-carboxylate Openeye Name: 3',6'-diacetoxy-3-oxo-spiro[isobenzofuran-1,9'-xanthene]-5-carboxylate CAS Name: 3',6'-diacetyloxy-3-oxo-5-spiro[isobenzofuran-1,9'-xanthene]carboxylate IUPAC Name: 3',6'-diacetyloxy-3-oxospiro[2-benzofuran-1,9'-xanthene]-5-carboxylate Traditional Name: 3',6'-diacetoxy-3-keto-spiro[phthalan-1,9'-xanthene]-5-carboxylate Formula: C25H15O9- MolecularWeight: 459.3812

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1=CC2=C(C=C1)C3(C4=C(C=C(C=C4)C(=O)[O-])C(=O)O3)C5=C(O2)C=C(C=C5)OC(=O)C

Isomeric SMILES

CC(=O)OC1=CC2=C(C=C1)C3(C4=C(C=C(C=C4)C(=O)[O-])C(=O)O3)C5=C(O2)C=C(C=C5)OC(=O)C

InChI

InChI=1S/C25H16O9/c1-12(26)31-15-4-7-19-21(10-15)33-22-11-16(32-13(2)27)5-8-20(22)25(19)18-6-3-14(23(28)29)9-17(18)24(30)34-25/h3-11H,1-2H3,(H,28,29)/p-1