ethyl 2-[[(2Z)-2-[(5-bromanyl-2-methoxy-phenyl)methylidene]-3-oxidanylidene-1-benzofuran-6-yl]oxy]propanoate

Systemtic Name: ethyl 2-[[(2Z)-2-[(5-bromanyl-2-methoxy-phenyl)methylidene]-3-oxidanylidene-1-benzofuran-6-yl]oxy]propanoate Openeye Name: ethyl 2-[(2Z)-2-[(5-bromo-2-methoxy-phenyl)methylene]-3-oxo-benzofuran-6-yl]oxypropanoate CAS Name: 2-[[(2Z)-2-[(5-bromo-2-methoxyphenyl)methylidene]-3-oxo-6-benzofuranyl]oxy]propanoic acid ethyl ester IUPAC Name: ethyl 2-[[(2Z)-2-[(5-bromo-2-methoxyphenyl)methylidene]-3-oxo-1-benzofuran-6-yl]oxy]propanoate Traditional Name: 2-[(2Z)-2-(5-bromo-2-methoxy-benzylidene)-3-keto-coumaran-6-yl]oxypropionic acid ethyl ester Formula: C21H19BrO6 MolecularWeight: 447.27596

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C)OC1=CC2=C(C=C1)C(=O)C(=CC3=C(C=CC(=C3)Br)OC)O2

Isomeric SMILES

CCOC(=O)C(C)OC1=CC2=C(C=C1)C(=O)/C(=C/C3=C(C=CC(=C3)Br)OC)/O2

InChI

InChI=1S/C21H19BrO6/c1-4-26-21(24)12(2)27-15-6-7-16-18(11-15)28-19(20(16)23)10-13-9-14(22)5-8-17(13)25-3/h5-12H,4H2,1-3H3/b19-10-