2-(5-chloranyl-2,3-dihydro-1,4-benzodioxin-7-yl)-1-[4-(phenylsulfonyl)piperazin-1-yl]ethanone

Systemtic Name: 2-(5-chloranyl-2,3-dihydro-1,4-benzodioxin-7-yl)-1-[4-(phenylsulfonyl)piperazin-1-yl]ethanone Openeye Name: 1-[4-(benzenesulfonyl)piperazin-1-yl]-2-(5-chloro-2,3-dihydro-1,4-benzodioxin-7-yl)ethanone CAS Name: 1-[4-(benzenesulfonyl)-1-piperazinyl]-2-(5-chloro-2,3-dihydro-1,4-benzodioxin-7-yl)ethanone IUPAC Name: 1-[4-(benzenesulfonyl)piperazin-1-yl]-2-(5-chloro-2,3-dihydro-1,4-benzodioxin-7-yl)ethanone Traditional Name: 1-(4-besylpiperazino)-2-(5-chloro-2,3-dihydro-1,4-benzodioxin-7-yl)ethanone Formula: C20H21ClN2O5S MolecularWeight: 436.90914

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)CC2=CC3=C(C(=C2)Cl)OCCO3)S(=O)(=O)C4=CC=CC=C4

Isomeric SMILES

C1CN(CCN1C(=O)CC2=CC3=C(C(=C2)Cl)OCCO3)S(=O)(=O)C4=CC=CC=C4

InChI

InChI=1S/C20H21ClN2O5S/c21-17-12-15(13-18-20(17)28-11-10-27-18)14-19(24)22-6-8-23(9-7-22)29(25,26)16-4-2-1-3-5-16/h1-5,12-13H,6-11,14H2