(3R)-3-[(2R)-2-(4-bromophenyl)-4,6-dimethoxy-3-oxidanylidene-1-benzofuran-2-yl]-3-phenyl-propanal

Systemtic Name: (3R)-3-[(2R)-2-(4-bromophenyl)-4,6-dimethoxy-3-oxidanylidene-1-benzofuran-2-yl]-3-phenyl-propanal Openeye Name: (3R)-3-[(2R)-2-(4-bromophenyl)-4,6-dimethoxy-3-oxo-benzofuran-2-yl]-3-phenyl-propanal CAS Name: (3R)-3-[(2R)-2-(4-bromophenyl)-4,6-dimethoxy-3-oxo-2-benzofuranyl]-3-phenylpropanal IUPAC Name: (3R)-3-[(2R)-2-(4-bromophenyl)-4,6-dimethoxy-3-oxo-1-benzofuran-2-yl]-3-phenylpropanal Traditional Name: (3R)-3-[(2R)-2-(4-bromophenyl)-3-keto-4,6-dimethoxy-coumaran-2-yl]-3-phenyl-propionaldehyde Formula: C25H21BrO5 MolecularWeight: 481.33524

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C2C(=C1)OC(C2=O)(C3=CC=C(C=C3)Br)C(CC=O)C4=CC=CC=C4)OC

Isomeric SMILES

COC1=CC(=C2C(=C1)O[C@@](C2=O)(C3=CC=C(C=C3)Br)[C@H](CC=O)C4=CC=CC=C4)OC

InChI

InChI=1S/C25H21BrO5/c1-29-19-14-21(30-2)23-22(15-19)31-25(24(23)28,17-8-10-18(26)11-9-17)20(12-13-27)16-6-4-3-5-7-16/h3-11,13-15,20H,12H2,1-2H3/t20-,25+/m1/s1