2-(4-bromanyl-2,3,5-trimethyl-phenoxy)-1-(3,4-dihydro-1H-isoquinolin-2-yl)ethanone

Systemtic Name: 2-(4-bromanyl-2,3,5-trimethyl-phenoxy)-1-(3,4-dihydro-1H-isoquinolin-2-yl)ethanone Openeye Name: 2-(4-bromo-2,3,5-trimethyl-phenoxy)-1-(3,4-dihydro-1H-isoquinolin-2-yl)ethanone CAS Name: 2-(4-bromo-2,3,5-trimethylphenoxy)-1-(3,4-dihydro-1H-isoquinolin-2-yl)ethanone IUPAC Name: 2-(4-bromo-2,3,5-trimethylphenoxy)-1-(3,4-dihydro-1H-isoquinolin-2-yl)ethanone Traditional Name: 2-(4-bromo-2,3,5-trimethyl-phenoxy)-1-(3,4-dihydro-1H-isoquinolin-2-yl)ethanone Formula: C20H22BrNO2 MolecularWeight: 388.29818

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1Br)C)C)OCC(=O)N2CCC3=CC=CC=C3C2

Isomeric SMILES

CC1=CC(=C(C(=C1Br)C)C)OCC(=O)N2CCC3=CC=CC=C3C2

InChI

InChI=1S/C20H22BrNO2/c1-13-10-18(14(2)15(3)20(13)21)24-12-19(23)22-9-8-16-6-4-5-7-17(16)11-22/h4-7,10H,8-9,11-12H2,1-3H3