2-(4-bromanylphenoxy)-1-[4-[(5-fluoranyl-2-methoxy-phenyl)methyl]piperazin-1-yl]ethanone

Systemtic Name: 2-(4-bromanylphenoxy)-1-[4-[(5-fluoranyl-2-methoxy-phenyl)methyl]piperazin-1-yl]ethanone Openeye Name: 2-(4-bromophenoxy)-1-[4-[(5-fluoro-2-methoxy-phenyl)methyl]piperazin-1-yl]ethanone CAS Name: 2-(4-bromophenoxy)-1-[4-[(5-fluoro-2-methoxyphenyl)methyl]-1-piperazinyl]ethanone IUPAC Name: 2-(4-bromophenoxy)-1-[4-[(5-fluoro-2-methoxyphenyl)methyl]piperazin-1-yl]ethanone Traditional Name: 2-(4-bromophenoxy)-1-[4-(5-fluoro-2-methoxy-benzyl)piperazino]ethanone Formula: C20H22BrFN2O3 MolecularWeight: 437.302683

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H22BrFN2O3/c1-26-19-7-4-17(22)12-15(19)13-23-8-10-24(11-9-23)20(25)14-27-18-5-2-16(21)3-6-18/h2-7,12H,8-11,13-14H2,1H3