ethyl (1E)-1-[(2-bromanyl-4,5-dimethoxy-phenyl)methylidene]-6,7-dimethoxy-3,4-dihydroisoquinoline-2-carboxylate

Systemtic Name: ethyl (1E)-1-[(2-bromanyl-4,5-dimethoxy-phenyl)methylidene]-6,7-dimethoxy-3,4-dihydroisoquinoline-2-carboxylate Openeye Name: ethyl (1E)-1-[(2-bromo-4,5-dimethoxy-phenyl)methylene]-6,7-dimethoxy-3,4-dihydroisoquinoline-2-carboxylate CAS Name: (1E)-1-[(2-bromo-4,5-dimethoxyphenyl)methylidene]-6,7-dimethoxy-3,4-dihydroisoquinoline-2-carboxylic acid ethyl ester IUPAC Name: ethyl (1E)-1-[(2-bromo-4,5-dimethoxyphenyl)methylidene]-6,7-dimethoxy-3,4-dihydroisoquinoline-2-carboxylate Traditional Name: (1E)-1-(2-bromo-4,5-dimethoxy-benzylidene)-6,7-dimethoxy-3,4-dihydroisoquinoline-2-carboxylic acid ethyl ester Formula: C23H26BrNO6 MolecularWeight: 492.35964

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCC2=CC(=C(C=C2C1=CC3=CC(=C(C=C3Br)OC)OC)OC)OC

Isomeric SMILES

CCOC(=O)N\1CCC2=CC(=C(C=C2/C1=C\C3=CC(=C(C=C3Br)OC)OC)OC)OC

InChI

InChI=1S/C23H26BrNO6/c1-6-31-23(26)25-8-7-14-10-19(27-2)21(29-4)12-16(14)18(25)9-15-11-20(28-3)22(30-5)13-17(15)24/h9-13H,6-8H2,1-5H3/b18-9+