6,7-dibutoxyspiro[2-benzofuran-3,9'-xanthene]-1-one

Systemtic Name: 6,7-dibutoxyspiro[2-benzofuran-3,9'-xanthene]-1-one Openeye Name: 6,7-dibutoxyspiro[isobenzofuran-3,9'-xanthene]-1-one CAS Name: 6,7-dibutoxy-1-spiro[isobenzofuran-3,9'-xanthene]one IUPAC Name: 6,7-dibutoxyspiro[2-benzofuran-3,9'-xanthene]-1-one Traditional Name: 6,7-dibutoxyspiro[phthalan-3,9'-xanthene]-1-one Formula: C28H28O5 MolecularWeight: 444.51892

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=C(C2=C(C=C1)C3(C4=CC=CC=C4OC5=CC=CC=C53)OC2=O)OCCCC

Isomeric SMILES

CCCCOC1=C(C2=C(C=C1)C3(C4=CC=CC=C4OC5=CC=CC=C53)OC2=O)OCCCC

InChI

InChI=1S/C28H28O5/c1-3-5-17-30-24-16-15-21-25(26(24)31-18-6-4-2)27(29)33-28(21)19-11-7-9-13-22(19)32-23-14-10-8-12-20(23)28/h7-16H,3-6,17-18H2,1-2H3