1-[4-[4-[2-(4-bromanylphenoxy)ethyl]piperazin-1-yl]sulfonylphenyl]ethanone

Systemtic Name: 1-[4-[4-[2-(4-bromanylphenoxy)ethyl]piperazin-1-yl]sulfonylphenyl]ethanone Openeye Name: 1-[4-[4-[2-(4-bromophenoxy)ethyl]piperazin-1-yl]sulfonylphenyl]ethanone CAS Name: 1-[4-[[4-[2-(4-bromophenoxy)ethyl]-1-piperazinyl]sulfonyl]phenyl]ethanone IUPAC Name: 1-[4-[4-[2-(4-bromophenoxy)ethyl]piperazin-1-yl]sulfonylphenyl]ethanone Traditional Name: 1-[4-[4-[2-(4-bromophenoxy)ethyl]piperazino]sulfonylphenyl]ethanone Formula: C20H23BrN2O4S MolecularWeight: 467.37662

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)CCOC3=CC=C(C=C3)Br

Isomeric SMILES

CC(=O)C1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)CCOC3=CC=C(C=C3)Br

InChI

InChI=1S/C20H23BrN2O4S/c1-16(24)17-2-8-20(9-3-17)28(25,26)23-12-10-22(11-13-23)14-15-27-19-6-4-18(21)5-7-19/h2-9H,10-15H2,1H3