(3E)-3-[(2-bromanyl-6-phenylmethoxy-phenyl)methylidene]-5,6-dimethoxy-2-[(4-methoxyphenyl)methyl]isoindol-1-one

Systemtic Name: (3E)-3-[(2-bromanyl-6-phenylmethoxy-phenyl)methylidene]-5,6-dimethoxy-2-[(4-methoxyphenyl)methyl]isoindol-1-one Openeye Name: (3E)-3-[(2-benzyloxy-6-bromo-phenyl)methylene]-5,6-dimethoxy-2-[(4-methoxyphenyl)methyl]isoindolin-1-one CAS Name: (3E)-3-[(2-bromo-6-phenylmethoxyphenyl)methylidene]-5,6-dimethoxy-2-[(4-methoxyphenyl)methyl]-1-isoindolone IUPAC Name: (3E)-3-[(2-bromo-6-phenylmethoxyphenyl)methylidene]-5,6-dimethoxy-2-[(4-methoxyphenyl)methyl]isoindol-1-one Traditional Name: (3E)-3-(2-benzoxy-6-bromo-benzylidene)-5,6-dimethoxy-2-p-anisyl-isoindolin-1-one Formula: C32H28BrNO5 MolecularWeight: 586.47242

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CN2C(=CC3=C(C=CC=C3Br)OCC4=CC=CC=C4)C5=CC(=C(C=C5C2=O)OC)OC

Isomeric SMILES

COC1=CC=C(C=C1)CN2/C(=C/C3=C(C=CC=C3Br)OCC4=CC=CC=C4)/C5=CC(=C(C=C5C2=O)OC)OC

InChI

InChI=1S/C32H28BrNO5/c1-36-23-14-12-21(13-15-23)19-34-28(24-17-30(37-2)31(38-3)18-25(24)32(34)35)16-26-27(33)10-7-11-29(26)39-20-22-8-5-4-6-9-22/h4-18H,19-20H2,1-3H3/b28-16+