1-[4-(5-bromanylpyridin-2-yl)piperazin-1-yl]-2-(3,5-dimethylphenoxy)ethanone

Systemtic Name: 1-[4-(5-bromanylpyridin-2-yl)piperazin-1-yl]-2-(3,5-dimethylphenoxy)ethanone Openeye Name: 1-[4-(5-bromo-2-pyridyl)piperazin-1-yl]-2-(3,5-dimethylphenoxy)ethanone CAS Name: 1-[4-(5-bromo-2-pyridinyl)-1-piperazinyl]-2-(3,5-dimethylphenoxy)ethanone IUPAC Name: 1-[4-(5-bromopyridin-2-yl)piperazin-1-yl]-2-(3,5-dimethylphenoxy)ethanone Traditional Name: 1-[4-(5-bromo-2-pyridyl)piperazino]-2-(3,5-dimethylphenoxy)ethanone Formula: C19H22BrN3O2 MolecularWeight: 404.30088

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)OCC(=O)N2CCN(CC2)C3=NC=C(C=C3)Br)C

Isomeric SMILES

CC1=CC(=CC(=C1)OCC(=O)N2CCN(CC2)C3=NC=C(C=C3)Br)C

InChI

InChI=1S/C19H22BrN3O2/c1-14-9-15(2)11-17(10-14)25-13-19(24)23-7-5-22(6-8-23)18-4-3-16(20)12-21-18/h3-4,9-12H,5-8,13H2,1-2H3