[5-[(1-butanoyloxy-3-oxidanylidene-1H-2-benzofuran-5-yl)carbonyl]-3-oxidanylidene-1H-2-benzofuran-1-yl] butanoate

Systemtic Name: [5-[(1-butanoyloxy-3-oxidanylidene-1H-2-benzofuran-5-yl)carbonyl]-3-oxidanylidene-1H-2-benzofuran-1-yl] butanoate Openeye Name: [5-(1-butanoyloxy-3-oxo-1H-isobenzofuran-5-carbonyl)-3-oxo-1H-isobenzofuran-1-yl] butanoate CAS Name: butanoic acid [3-oxo-5-[oxo-[3-oxo-1-(1-oxobutoxy)-1H-isobenzofuran-5-yl]methyl]-1H-isobenzofuran-1-yl] ester IUPAC Name: [5-(1-butanoyloxy-3-oxo-1H-2-benzofuran-5-carbonyl)-3-oxo-1H-2-benzofuran-1-yl] butanoate Traditional Name: butyric acid [5-(1-butyryloxy-3-keto-phthalan-5-carbonyl)-3-keto-phthalan-1-yl] ester Formula: C25H22O9 MolecularWeight: 466.43678

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)OC1C2=C(C=C(C=C2)C(=O)C3=CC4=C(C=C3)C(OC4=O)OC(=O)CCC)C(=O)O1

Isomeric SMILES

CCCC(=O)OC1C2=C(C=C(C=C2)C(=O)C3=CC4=C(C=C3)C(OC4=O)OC(=O)CCC)C(=O)O1

InChI

InChI=1S/C25H22O9/c1-3-5-19(26)31-24-15-9-7-13(11-17(15)22(29)33-24)21(28)14-8-10-16-18(12-14)23(30)34-25(16)32-20(27)6-4-2/h7-12,24-25H,3-6H2,1-2H3