(5-bromanyl-1-benzofuran-2-yl)-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)methanone

Systemtic Name: (5-bromanyl-1-benzofuran-2-yl)-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)methanone Openeye Name: (5-bromobenzofuran-2-yl)-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)methanone CAS Name: (5-bromo-2-benzofuranyl)-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)methanone IUPAC Name: (5-bromo-1-benzofuran-2-yl)-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)methanone Traditional Name: (5-bromobenzofuran-2-yl)-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)methanone Formula: C20H18BrNO4 MolecularWeight: 416.26522

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2CN(CCC2=C1)C(=O)C3=CC4=C(O3)C=CC(=C4)Br)OC

Isomeric SMILES

COC1=C(C=C2CN(CCC2=C1)C(=O)C3=CC4=C(O3)C=CC(=C4)Br)OC

InChI

InChI=1S/C20H18BrNO4/c1-24-17-8-12-5-6-22(11-14(12)10-18(17)25-2)20(23)19-9-13-7-15(21)3-4-16(13)26-19/h3-4,7-10H,5-6,11H2,1-2H3