2-(2-bromanyl-4-tert-butyl-phenoxy)-1-(3,4-dihydro-1H-isoquinolin-2-yl)ethanone

Systemtic Name: 2-(2-bromanyl-4-tert-butyl-phenoxy)-1-(3,4-dihydro-1H-isoquinolin-2-yl)ethanone Openeye Name: 2-(2-bromo-4-tert-butyl-phenoxy)-1-(3,4-dihydro-1H-isoquinolin-2-yl)ethanone CAS Name: 2-(2-bromo-4-tert-butylphenoxy)-1-(3,4-dihydro-1H-isoquinolin-2-yl)ethanone IUPAC Name: 2-(2-bromo-4-tert-butylphenoxy)-1-(3,4-dihydro-1H-isoquinolin-2-yl)ethanone Traditional Name: 2-(2-bromo-4-tert-butyl-phenoxy)-1-(3,4-dihydro-1H-isoquinolin-2-yl)ethanone Formula: C21H24BrNO2 MolecularWeight: 402.32476

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H24BrNO2/c1-21(2,3)17-8-9-19(18(22)12-17)25-14-20(24)23-11-10-15-6-4-5-7-16(15)13-23/h4-9,12H,10-11,13-14H2,1-3H3