1-[4-(phenylsulfonyl)piperazin-1-yl]-2-(2-propoxyphenoxy)ethanone

Systemtic Name: 1-[4-(phenylsulfonyl)piperazin-1-yl]-2-(2-propoxyphenoxy)ethanone Openeye Name: 1-[4-(benzenesulfonyl)piperazin-1-yl]-2-(2-propoxyphenoxy)ethanone CAS Name: 1-[4-(benzenesulfonyl)-1-piperazinyl]-2-(2-propoxyphenoxy)ethanone IUPAC Name: 1-[4-(benzenesulfonyl)piperazin-1-yl]-2-(2-propoxyphenoxy)ethanone Traditional Name: 1-(4-besylpiperazino)-2-(2-propoxyphenoxy)ethanone Formula: C21H26N2O5S MolecularWeight: 418.50654

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC=CC=C1OCC(=O)N2CCN(CC2)S(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

CCCOC1=CC=CC=C1OCC(=O)N2CCN(CC2)S(=O)(=O)C3=CC=CC=C3

InChI

InChI=1S/C21H26N2O5S/c1-2-16-27-19-10-6-7-11-20(19)28-17-21(24)22-12-14-23(15-13-22)29(25,26)18-8-4-3-5-9-18/h3-11H,2,12-17H2,1H3