butyl 3-oxidanylidenespiro[2-benzofuran-1,9'-xanthene]-3'-carboxylate

Systemtic Name: butyl 3-oxidanylidenespiro[2-benzofuran-1,9'-xanthene]-3'-carboxylate Openeye Name: butyl 3-oxospiro[isobenzofuran-1,9'-xanthene]-3'-carboxylate CAS Name: 3-oxo-3'-spiro[isobenzofuran-1,9'-xanthene]carboxylic acid butyl ester IUPAC Name: butyl 3-oxospiro[2-benzofuran-1,9'-xanthene]-3'-carboxylate Traditional Name: 3-ketospiro[phthalan-1,9'-xanthene]-3'-carboxylic acid butyl ester Formula: C25H20O5 MolecularWeight: 400.4233

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)C1=CC2=C(C=C1)C3(C4=CC=CC=C4C(=O)O3)C5=CC=CC=C5O2

Isomeric SMILES

CCCCOC(=O)C1=CC2=C(C=C1)C3(C4=CC=CC=C4C(=O)O3)C5=CC=CC=C5O2

InChI

InChI=1S/C25H20O5/c1-2-3-14-28-23(26)16-12-13-20-22(15-16)29-21-11-7-6-10-19(21)25(20)18-9-5-4-8-17(18)24(27)30-25/h4-13,15H,2-3,14H2,1H3