(3E)-3-[(3-bromanyl-5-methoxy-4-oxidanyl-phenyl)methylidene]-6-methoxy-chromen-4-one

Systemtic Name: (3E)-3-[(3-bromanyl-5-methoxy-4-oxidanyl-phenyl)methylidene]-6-methoxy-chromen-4-one Openeye Name: (3E)-3-[(3-bromo-4-hydroxy-5-methoxy-phenyl)methylene]-6-methoxy-chroman-4-one CAS Name: (3E)-3-[(3-bromo-4-hydroxy-5-methoxyphenyl)methylidene]-6-methoxy-3,4-dihydro-2H-1-benzopyran-4-one IUPAC Name: (3E)-3-[(3-bromo-4-hydroxy-5-methoxyphenyl)methylidene]-6-methoxychromen-4-one Traditional Name: (3E)-3-(3-bromo-4-hydroxy-5-methoxy-benzylidene)-6-methoxy-chroman-4-one Formula: C18H15BrO5 MolecularWeight: 391.2127

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)OCC(=CC3=CC(=C(C(=C3)Br)O)OC)C2=O

Isomeric SMILES

COC1=CC2=C(C=C1)OC/C(=C\C3=CC(=C(C(=C3)Br)O)OC)/C2=O

InChI

InChI=1S/C18H15BrO5/c1-22-12-3-4-15-13(8-12)17(20)11(9-24-15)5-10-6-14(19)18(21)16(7-10)23-2/h3-8,21H,9H2,1-2H3/b11-5+