2-[4-bromanyl-2-(hydroxymethyl)phenoxy]-1-(3,4-dihydro-1H-isoquinolin-2-yl)ethanone

Systemtic Name: 2-[4-bromanyl-2-(hydroxymethyl)phenoxy]-1-(3,4-dihydro-1H-isoquinolin-2-yl)ethanone Openeye Name: 2-[4-bromo-2-(hydroxymethyl)phenoxy]-1-(3,4-dihydro-1H-isoquinolin-2-yl)ethanone CAS Name: 2-[4-bromo-2-(hydroxymethyl)phenoxy]-1-(3,4-dihydro-1H-isoquinolin-2-yl)ethanone IUPAC Name: 2-[4-bromo-2-(hydroxymethyl)phenoxy]-1-(3,4-dihydro-1H-isoquinolin-2-yl)ethanone Traditional Name: 2-(4-bromo-2-methylol-phenoxy)-1-(3,4-dihydro-1H-isoquinolin-2-yl)ethanone Formula: C18H18BrNO3 MolecularWeight: 376.24442

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC2=CC=CC=C21)C(=O)COC3=C(C=C(C=C3)Br)CO

Isomeric SMILES

C1CN(CC2=CC=CC=C21)C(=O)COC3=C(C=C(C=C3)Br)CO

InChI

InChI=1S/C18H18BrNO3/c19-16-5-6-17(15(9-16)11-21)23-12-18(22)20-8-7-13-3-1-2-4-14(13)10-20/h1-6,9,21H,7-8,10-12H2