2-[2,6-bis(bromanyl)-4-methyl-phenoxy]-1-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)ethanone

Systemtic Name: 2-[2,6-bis(bromanyl)-4-methyl-phenoxy]-1-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)ethanone Openeye Name: 2-(2,6-dibromo-4-methyl-phenoxy)-1-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)ethanone CAS Name: 2-(2,6-dibromo-4-methylphenoxy)-1-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)ethanone IUPAC Name: 2-(2,6-dibromo-4-methylphenoxy)-1-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)ethanone Traditional Name: 2-(2,6-dibromo-4-methyl-phenoxy)-1-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)ethanone Formula: C20H21Br2NO4 MolecularWeight: 499.19304

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)Br)OCC(=O)N2CCC3=CC(=C(C=C3C2)OC)OC)Br

Isomeric SMILES

CC1=CC(=C(C(=C1)Br)OCC(=O)N2CCC3=CC(=C(C=C3C2)OC)OC)Br

InChI

InChI=1S/C20H21Br2NO4/c1-12-6-15(21)20(16(22)7-12)27-11-19(24)23-5-4-13-8-17(25-2)18(26-3)9-14(13)10-23/h6-9H,4-5,10-11H2,1-3H3