1-[4-(5-bromanylpyridin-2-yl)piperazin-1-yl]-2-(6-methoxy-1-benzofuran-3-yl)ethanone

Systemtic Name: 1-[4-(5-bromanylpyridin-2-yl)piperazin-1-yl]-2-(6-methoxy-1-benzofuran-3-yl)ethanone Openeye Name: 1-[4-(5-bromo-2-pyridyl)piperazin-1-yl]-2-(6-methoxybenzofuran-3-yl)ethanone CAS Name: 1-[4-(5-bromo-2-pyridinyl)-1-piperazinyl]-2-(6-methoxy-3-benzofuranyl)ethanone IUPAC Name: 1-[4-(5-bromopyridin-2-yl)piperazin-1-yl]-2-(6-methoxy-1-benzofuran-3-yl)ethanone Traditional Name: 1-[4-(5-bromo-2-pyridyl)piperazino]-2-(6-methoxybenzofuran-3-yl)ethanone Formula: C20H20BrN3O3 MolecularWeight: 430.2951

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)C(=CO2)CC(=O)N3CCN(CC3)C4=NC=C(C=C4)Br

Isomeric SMILES

COC1=CC2=C(C=C1)C(=CO2)CC(=O)N3CCN(CC3)C4=NC=C(C=C4)Br

InChI

InChI=1S/C20H20BrN3O3/c1-26-16-3-4-17-14(13-27-18(17)11-16)10-20(25)24-8-6-23(7-9-24)19-5-2-15(21)12-22-19/h2-5,11-13H,6-10H2,1H3