(3Z)-4-methoxy-6,7-bis(oxidanyl)-3-(phenylmethylidene)-5-(3-phenylpropanoyl)-1-benzofuran-2-one

Systemtic Name: (3Z)-4-methoxy-6,7-bis(oxidanyl)-3-(phenylmethylidene)-5-(3-phenylpropanoyl)-1-benzofuran-2-one Openeye Name: (3Z)-3-benzylidene-6,7-dihydroxy-4-methoxy-5-(3-phenylpropanoyl)benzofuran-2-one CAS Name: (3Z)-6,7-dihydroxy-4-methoxy-5-(1-oxo-3-phenylpropyl)-3-(phenylmethylene)-2-benzofuranone IUPAC Name: (3Z)-3-benzylidene-6,7-dihydroxy-4-methoxy-5-(3-phenylpropanoyl)-1-benzofuran-2-one Traditional Name: (3Z)-3-benzal-5-hydrocinnamoyl-6,7-dihydroxy-4-methoxy-coumaran-2-one Formula: C25H20O6 MolecularWeight: 416.4227

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=C(C2=C1C(=CC3=CC=CC=C3)C(=O)O2)O)O)C(=O)CCC4=CC=CC=C4

Isomeric SMILES

COC1=C(C(=C(C2=C1/C(=C/C3=CC=CC=C3)/C(=O)O2)O)O)C(=O)CCC4=CC=CC=C4

InChI

InChI=1S/C25H20O6/c1-30-23-19-17(14-16-10-6-3-7-11-16)25(29)31-24(19)22(28)21(27)20(23)18(26)13-12-15-8-4-2-5-9-15/h2-11,14,27-28H,12-13H2,1H3/b17-14-