(3E)-3-[(6-bromanyl-1,3-benzodioxol-5-yl)methylidene]-6-methoxy-chromen-4-one

Systemtic Name: (3E)-3-[(6-bromanyl-1,3-benzodioxol-5-yl)methylidene]-6-methoxy-chromen-4-one Openeye Name: (3E)-3-[(6-bromo-1,3-benzodioxol-5-yl)methylene]-6-methoxy-chroman-4-one CAS Name: (3E)-3-[(6-bromo-1,3-benzodioxol-5-yl)methylidene]-6-methoxy-3,4-dihydro-2H-1-benzopyran-4-one IUPAC Name: (3E)-3-[(6-bromo-1,3-benzodioxol-5-yl)methylidene]-6-methoxychromen-4-one Traditional Name: (3E)-3-[(6-bromo-1,3-benzodioxol-5-yl)methylene]-6-methoxy-chroman-4-one Formula: C18H13BrO5 MolecularWeight: 389.19682

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)OCC(=CC3=CC4=C(C=C3Br)OCO4)C2=O

Isomeric SMILES

COC1=CC2=C(C=C1)OC/C(=C\C3=CC4=C(C=C3Br)OCO4)/C2=O

InChI

InChI=1S/C18H13BrO5/c1-21-12-2-3-15-13(6-12)18(20)11(8-22-15)4-10-5-16-17(7-14(10)19)24-9-23-16/h2-7H,8-9H2,1H3/b11-4+