(2E)-2-[(4-hexoxy-2-oxidanyl-phenyl)methylidene]-6,7-bis(oxidanyl)-1-benzofuran-3-one

Systemtic Name: (2E)-2-[(4-hexoxy-2-oxidanyl-phenyl)methylidene]-6,7-bis(oxidanyl)-1-benzofuran-3-one Openeye Name: (2E)-2-[(4-hexoxy-2-hydroxy-phenyl)methylene]-6,7-dihydroxy-benzofuran-3-one CAS Name: (2E)-2-[(4-hexoxy-2-hydroxyphenyl)methylidene]-6,7-dihydroxy-3-benzofuranone IUPAC Name: (2E)-2-[(4-hexoxy-2-hydroxyphenyl)methylidene]-6,7-dihydroxy-1-benzofuran-3-one Traditional Name: (2E)-2-(4-hexoxy-2-hydroxy-benzylidene)-6,7-dihydroxy-coumaran-3-one Formula: C21H22O6 MolecularWeight: 370.39578

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC1=CC(=C(C=C1)C=C2C(=O)C3=C(O2)C(=C(C=C3)O)O)O

Isomeric SMILES

CCCCCCOC1=CC(=C(C=C1)/C=C/2\C(=O)C3=C(O2)C(=C(C=C3)O)O)O

InChI

InChI=1S/C21H22O6/c1-2-3-4-5-10-26-14-7-6-13(17(23)12-14)11-18-19(24)15-8-9-16(22)20(25)21(15)27-18/h6-9,11-12,22-23,25H,2-5,10H2,1H3/b18-11+