1-[4-[2-(4-bromophenyl)sulfonylethyl]piperazin-1-yl]ethanone

Systemtic Name: 1-[4-[2-(4-bromophenyl)sulfonylethyl]piperazin-1-yl]ethanone Openeye Name: 1-[4-[2-(4-bromophenyl)sulfonylethyl]piperazin-1-yl]ethanone CAS Name: 1-[4-[2-(4-bromophenyl)sulfonylethyl]-1-piperazinyl]ethanone IUPAC Name: 1-[4-[2-(4-bromophenyl)sulfonylethyl]piperazin-1-yl]ethanone Traditional Name: 1-[4-(2-brosylethyl)piperazino]ethanone Formula: C14H19BrN2O3S MolecularWeight: 375.28126

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1CCN(CC1)CCS(=O)(=O)C2=CC=C(C=C2)Br

Isomeric SMILES

CC(=O)N1CCN(CC1)CCS(=O)(=O)C2=CC=C(C=C2)Br

InChI

InChI=1S/C14H19BrN2O3S/c1-12(18)17-8-6-16(7-9-17)10-11-21(19,20)14-4-2-13(15)3-5-14/h2-5H,6-11H2,1H3