2-(6-methoxy-1-benzofuran-3-yl)-1-[4-(phenylsulfonyl)piperazin-1-yl]ethanone

Systemtic Name: 2-(6-methoxy-1-benzofuran-3-yl)-1-[4-(phenylsulfonyl)piperazin-1-yl]ethanone Openeye Name: 1-[4-(benzenesulfonyl)piperazin-1-yl]-2-(6-methoxybenzofuran-3-yl)ethanone CAS Name: 1-[4-(benzenesulfonyl)-1-piperazinyl]-2-(6-methoxy-3-benzofuranyl)ethanone IUPAC Name: 1-[4-(benzenesulfonyl)piperazin-1-yl]-2-(6-methoxy-1-benzofuran-3-yl)ethanone Traditional Name: 1-(4-besylpiperazino)-2-(6-methoxybenzofuran-3-yl)ethanone Formula: C21H22N2O5S MolecularWeight: 414.47478

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)C(=CO2)CC(=O)N3CCN(CC3)S(=O)(=O)C4=CC=CC=C4

Isomeric SMILES

COC1=CC2=C(C=C1)C(=CO2)CC(=O)N3CCN(CC3)S(=O)(=O)C4=CC=CC=C4

InChI

InChI=1S/C21H22N2O5S/c1-27-17-7-8-19-16(15-28-20(19)14-17)13-21(24)22-9-11-23(12-10-22)29(25,26)18-5-3-2-4-6-18/h2-8,14-15H,9-13H2,1H3