[5,7-bis(bromanyl)quinolin-8-yl] 2-(2-methyl-3,4-dihydro-1H-isoquinolin-1-yl)ethanoate

Systemtic Name: [5,7-bis(bromanyl)quinolin-8-yl] 2-(2-methyl-3,4-dihydro-1H-isoquinolin-1-yl)ethanoate Openeye Name: (5,7-dibromo-8-quinolyl) 2-(2-methyl-3,4-dihydro-1H-isoquinolin-1-yl)acetate CAS Name: 2-(2-methyl-3,4-dihydro-1H-isoquinolin-1-yl)acetic acid (5,7-dibromo-8-quinolinyl) ester IUPAC Name: (5,7-dibromoquinolin-8-yl) 2-(2-methyl-3,4-dihydro-1H-isoquinolin-1-yl)acetate Traditional Name: 2-(2-methyl-3,4-dihydro-1H-isoquinolin-1-yl)acetic acid (5,7-dibromo-8-quinolyl) ester Formula: C21H18Br2N2O2 MolecularWeight: 490.18782

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCC2=CC=CC=C2C1CC(=O)OC3=C(C=C(C4=C3N=CC=C4)Br)Br

Isomeric SMILES

CN1CCC2=CC=CC=C2C1CC(=O)OC3=C(C=C(C4=C3N=CC=C4)Br)Br

InChI

InChI=1S/C21H18Br2N2O2/c1-25-10-8-13-5-2-3-6-14(13)18(25)12-19(26)27-21-17(23)11-16(22)15-7-4-9-24-20(15)21/h2-7,9,11,18H,8,10,12H2,1H3