1-[(2-bromanyl-4,5-dimethoxy-phenyl)methyl]-6,7-dimethoxy-2H-isoquinolin-3-one

Systemtic Name: 1-[(2-bromanyl-4,5-dimethoxy-phenyl)methyl]-6,7-dimethoxy-2H-isoquinolin-3-one Openeye Name: 1-[(2-bromo-4,5-dimethoxy-phenyl)methyl]-6,7-dimethoxy-2H-isoquinolin-3-one CAS Name: 1-[(2-bromo-4,5-dimethoxyphenyl)methyl]-6,7-dimethoxy-2H-isoquinolin-3-one IUPAC Name: 1-[(2-bromo-4,5-dimethoxyphenyl)methyl]-6,7-dimethoxy-2H-isoquinolin-3-one Traditional Name: 1-(2-bromo-4,5-dimethoxy-benzyl)-6,7-dimethoxy-3-isoquinolone Formula: C20H20BrNO5 MolecularWeight: 434.2805

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=CC(=O)NC(=C2C=C1OC)CC3=CC(=C(C=C3Br)OC)OC

Isomeric SMILES

COC1=CC2=CC(=O)NC(=C2C=C1OC)CC3=CC(=C(C=C3Br)OC)OC

InChI

InChI=1S/C20H20BrNO5/c1-24-16-6-11-8-20(23)22-15(13(11)9-18(16)26-3)5-12-7-17(25-2)19(27-4)10-14(12)21/h6-10H,5H2,1-4H3,(H,22,23)