ethyl 2-[[(2Z)-2-[(3-bromophenyl)methylidene]-3-oxidanylidene-1-benzofuran-6-yl]oxy]propanoate

Systemtic Name: ethyl 2-[[(2Z)-2-[(3-bromophenyl)methylidene]-3-oxidanylidene-1-benzofuran-6-yl]oxy]propanoate Openeye Name: ethyl 2-[(2Z)-2-[(3-bromophenyl)methylene]-3-oxo-benzofuran-6-yl]oxypropanoate CAS Name: 2-[[(2Z)-2-[(3-bromophenyl)methylidene]-3-oxo-6-benzofuranyl]oxy]propanoic acid ethyl ester IUPAC Name: ethyl 2-[[(2Z)-2-[(3-bromophenyl)methylidene]-3-oxo-1-benzofuran-6-yl]oxy]propanoate Traditional Name: 2-[(2Z)-2-(3-bromobenzylidene)-3-keto-coumaran-6-yl]oxypropionic acid ethyl ester Formula: C20H17BrO5 MolecularWeight: 417.24998

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H17BrO5/c1-3-24-20(23)12(2)25-15-7-8-16-17(11-15)26-18(19(16)22)10-13-5-4-6-14(21)9-13/h4-12H,3H2,1-2H3/b18-10-