2-(4-bromanyl-2-fluoranyl-phenoxy)-1-[4-[(3-fluoranyl-4-methoxy-phenyl)methyl]piperazin-1-yl]ethanone

Systemtic Name: 2-(4-bromanyl-2-fluoranyl-phenoxy)-1-[4-[(3-fluoranyl-4-methoxy-phenyl)methyl]piperazin-1-yl]ethanone Openeye Name: 2-(4-bromo-2-fluoro-phenoxy)-1-[4-[(3-fluoro-4-methoxy-phenyl)methyl]piperazin-1-yl]ethanone CAS Name: 2-(4-bromo-2-fluorophenoxy)-1-[4-[(3-fluoro-4-methoxyphenyl)methyl]-1-piperazinyl]ethanone IUPAC Name: 2-(4-bromo-2-fluorophenoxy)-1-[4-[(3-fluoro-4-methoxyphenyl)methyl]piperazin-1-yl]ethanone Traditional Name: 2-(4-bromo-2-fluoro-phenoxy)-1-[4-(3-fluoro-4-methoxy-benzyl)piperazino]ethanone Formula: C20H21BrF2N2O3 MolecularWeight: 455.293146

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CN2CCN(CC2)C(=O)COC3=C(C=C(C=C3)Br)F)F

Isomeric SMILES

COC1=C(C=C(C=C1)CN2CCN(CC2)C(=O)COC3=C(C=C(C=C3)Br)F)F

InChI

InChI=1S/C20H21BrF2N2O3/c1-27-18-4-2-14(10-16(18)22)12-24-6-8-25(9-7-24)20(26)13-28-19-5-3-15(21)11-17(19)23/h2-5,10-11H,6-9,12-13H2,1H3