(4Z)-4-[(3-bromanyl-5-methoxy-4-oxidanyl-phenyl)methylidene]-2-[(4-methoxyphenyl)methyl]isoquinoline-1,3-dione

Systemtic Name: (4Z)-4-[(3-bromanyl-5-methoxy-4-oxidanyl-phenyl)methylidene]-2-[(4-methoxyphenyl)methyl]isoquinoline-1,3-dione Openeye Name: (4Z)-4-[(3-bromo-4-hydroxy-5-methoxy-phenyl)methylene]-2-[(4-methoxyphenyl)methyl]isoquinoline-1,3-dione CAS Name: (4Z)-4-[(3-bromo-4-hydroxy-5-methoxyphenyl)methylidene]-2-[(4-methoxyphenyl)methyl]isoquinoline-1,3-dione IUPAC Name: (4Z)-4-[(3-bromo-4-hydroxy-5-methoxyphenyl)methylidene]-2-[(4-methoxyphenyl)methyl]isoquinoline-1,3-dione Traditional Name: (4Z)-4-(3-bromo-4-hydroxy-5-methoxy-benzylidene)-2-p-anisyl-isoquinoline-1,3-quinone Formula: C25H20BrNO5 MolecularWeight: 494.334

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CN2C(=O)C3=CC=CC=C3C(=CC4=CC(=C(C(=C4)Br)O)OC)C2=O

Isomeric SMILES

COC1=CC=C(C=C1)CN2C(=O)C3=CC=CC=C3/C(=C/C4=CC(=C(C(=C4)Br)O)OC)/C2=O

InChI

InChI=1S/C25H20BrNO5/c1-31-17-9-7-15(8-10-17)14-27-24(29)19-6-4-3-5-18(19)20(25(27)30)11-16-12-21(26)23(28)22(13-16)32-2/h3-13,28H,14H2,1-2H3/b20-11-