tert-butyl 4-(3'-ethanoyl-6'-ethoxy-3-oxidanylidene-spiro[2-benzofuran-1,9'-xanthene]-5-yl)carbonylbenzoate

Systemtic Name: tert-butyl 4-(3'-ethanoyl-6'-ethoxy-3-oxidanylidene-spiro[2-benzofuran-1,9'-xanthene]-5-yl)carbonylbenzoate Openeye Name: tert-butyl 4-(3'-acetyl-6'-ethoxy-3-oxo-spiro[isobenzofuran-1,9'-xanthene]-5-carbonyl)benzoate CAS Name: 4-[(3'-acetyl-6'-ethoxy-3-oxo-5-spiro[isobenzofuran-1,9'-xanthene]yl)-oxomethyl]benzoic acid tert-butyl ester IUPAC Name: tert-butyl 4-(3'-acetyl-6'-ethoxy-3-oxospiro[2-benzofuran-1,9'-xanthene]-5-carbonyl)benzoate Traditional Name: 4-(3'-acetyl-6'-ethoxy-3-keto-spiro[phthalan-1,9'-xanthene]-5-carbonyl)benzoic acid tert-butyl ester Formula: C36H30O8 MolecularWeight: 590.6186

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC2=C(C=C1)C3(C4=C(C=C(C=C4)C(=O)C5=CC=C(C=C5)C(=O)OC(C)(C)C)C(=O)O3)C6=C(O2)C=C(C=C6)C(=O)C

Isomeric SMILES

CCOC1=CC2=C(C=C1)C3(C4=C(C=C(C=C4)C(=O)C5=CC=C(C=C5)C(=O)OC(C)(C)C)C(=O)O3)C6=C(O2)C=C(C=C6)C(=O)C

InChI

InChI=1S/C36H30O8/c1-6-41-25-13-16-29-31(19-25)42-30-18-23(20(2)37)11-15-28(30)36(29)27-14-12-24(17-26(27)34(40)44-36)32(38)21-7-9-22(10-8-21)33(39)43-35(3,4)5/h7-19H,6H2,1-5H3