1-[4-(1,3-benzodioxol-5-ylcarbonyl)piperazin-1-yl]-2-(4-bromanyl-2-fluoranyl-phenoxy)ethanone

Systemtic Name: 1-[4-(1,3-benzodioxol-5-ylcarbonyl)piperazin-1-yl]-2-(4-bromanyl-2-fluoranyl-phenoxy)ethanone Openeye Name: 1-[4-(1,3-benzodioxole-5-carbonyl)piperazin-1-yl]-2-(4-bromo-2-fluoro-phenoxy)ethanone CAS Name: 1-[4-[1,3-benzodioxol-5-yl(oxo)methyl]-1-piperazinyl]-2-(4-bromo-2-fluorophenoxy)ethanone IUPAC Name: 1-[4-(1,3-benzodioxole-5-carbonyl)piperazin-1-yl]-2-(4-bromo-2-fluorophenoxy)ethanone Traditional Name: 2-(4-bromo-2-fluoro-phenoxy)-1-(4-piperonyloylpiperazino)ethanone Formula: C20H18BrFN2O5 MolecularWeight: 465.269723

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)COC2=C(C=C(C=C2)Br)F)C(=O)C3=CC4=C(C=C3)OCO4

Isomeric SMILES

C1CN(CCN1C(=O)COC2=C(C=C(C=C2)Br)F)C(=O)C3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C20H18BrFN2O5/c21-14-2-4-16(15(22)10-14)27-11-19(25)23-5-7-24(8-6-23)20(26)13-1-3-17-18(9-13)29-12-28-17/h1-4,9-10H,5-8,11-12H2