1-[4-(2,3-dihydro-1H-inden-5-ylsulfonyl)piperazin-1-yl]-2-(2-fluoranylphenoxy)ethanone

Systemtic Name: 1-[4-(2,3-dihydro-1H-inden-5-ylsulfonyl)piperazin-1-yl]-2-(2-fluoranylphenoxy)ethanone Openeye Name: 2-(2-fluorophenoxy)-1-(4-indan-5-ylsulfonylpiperazin-1-yl)ethanone CAS Name: 1-[4-(2,3-dihydro-1H-inden-5-ylsulfonyl)-1-piperazinyl]-2-(2-fluorophenoxy)ethanone IUPAC Name: 1-[4-(2,3-dihydro-1H-inden-5-ylsulfonyl)piperazin-1-yl]-2-(2-fluorophenoxy)ethanone Traditional Name: 2-(2-fluorophenoxy)-1-(4-indan-5-ylsulfonylpiperazino)ethanone Formula: C21H23FN2O4S MolecularWeight: 418.481723

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC2=C(C1)C=C(C=C2)S(=O)(=O)N3CCN(CC3)C(=O)COC4=CC=CC=C4F

Isomeric SMILES

C1CC2=C(C1)C=C(C=C2)S(=O)(=O)N3CCN(CC3)C(=O)COC4=CC=CC=C4F

InChI

InChI=1S/C21H23FN2O4S/c22-19-6-1-2-7-20(19)28-15-21(25)23-10-12-24(13-11-23)29(26,27)18-9-8-16-4-3-5-17(16)14-18/h1-2,6-9,14H,3-5,10-13,15H2