[2-[(3-bromophenyl)methylidene]-3-oxidanylidene-1-benzofuran-6-yl] 2-methoxybenzoate

Systemtic Name: [2-[(3-bromophenyl)methylidene]-3-oxidanylidene-1-benzofuran-6-yl] 2-methoxybenzoate Openeye Name: [2-[(3-bromophenyl)methylene]-3-oxo-benzofuran-6-yl] 2-methoxybenzoate CAS Name: 2-methoxybenzoic acid [2-[(3-bromophenyl)methylidene]-3-oxo-6-benzofuranyl] ester IUPAC Name: [2-[(3-bromophenyl)methylidene]-3-oxo-1-benzofuran-6-yl] 2-methoxybenzoate Traditional Name: 2-methoxybenzoic acid [2-(3-bromobenzylidene)-3-keto-coumaran-6-yl] ester Formula: C23H15BrO5 MolecularWeight: 451.2662

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1C(=O)OC2=CC3=C(C=C2)C(=O)C(=CC4=CC(=CC=C4)Br)O3

Isomeric SMILES

COC1=CC=CC=C1C(=O)OC2=CC3=C(C=C2)C(=O)C(=CC4=CC(=CC=C4)Br)O3

InChI

InChI=1S/C23H15BrO5/c1-27-19-8-3-2-7-18(19)23(26)28-16-9-10-17-20(13-16)29-21(22(17)25)12-14-5-4-6-15(24)11-14/h2-13H,1H3