1-[4-(phenylmethyl)sulfonylpiperazin-1-yl]-2-[2-(trifluoromethyl)phenoxy]ethanone

Systemtic Name: 1-[4-(phenylmethyl)sulfonylpiperazin-1-yl]-2-[2-(trifluoromethyl)phenoxy]ethanone Openeye Name: 1-(4-benzylsulfonylpiperazin-1-yl)-2-[2-(trifluoromethyl)phenoxy]ethanone CAS Name: 1-[4-(phenylmethyl)sulfonyl-1-piperazinyl]-2-[2-(trifluoromethyl)phenoxy]ethanone IUPAC Name: 1-(4-benzylsulfonylpiperazin-1-yl)-2-[2-(trifluoromethyl)phenoxy]ethanone Traditional Name: 1-(4-benzylsulfonylpiperazino)-2-[2-(trifluoromethyl)phenoxy]ethanone Formula: C20H21F3N2O4S MolecularWeight: 442.45195

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)COC2=CC=CC=C2C(F)(F)F)S(=O)(=O)CC3=CC=CC=C3

Isomeric SMILES

C1CN(CCN1C(=O)COC2=CC=CC=C2C(F)(F)F)S(=O)(=O)CC3=CC=CC=C3

InChI

InChI=1S/C20H21F3N2O4S/c21-20(22,23)17-8-4-5-9-18(17)29-14-19(26)24-10-12-25(13-11-24)30(27,28)15-16-6-2-1-3-7-16/h1-9H,10-15H2