2-(2,3-dihydro-1,4-benzodioxin-6-ylsulfanyl)-1-[4-(phenylcarbonyl)piperidin-1-yl]ethanone

Systemtic Name: 2-(2,3-dihydro-1,4-benzodioxin-6-ylsulfanyl)-1-[4-(phenylcarbonyl)piperidin-1-yl]ethanone Openeye Name: 1-(4-benzoyl-1-piperidyl)-2-(2,3-dihydro-1,4-benzodioxin-6-ylsulfanyl)ethanone CAS Name: 1-(4-benzoyl-1-piperidinyl)-2-(2,3-dihydro-1,4-benzodioxin-6-ylthio)ethanone IUPAC Name: 1-(4-benzoylpiperidin-1-yl)-2-(2,3-dihydro-1,4-benzodioxin-6-ylsulfanyl)ethanone Traditional Name: 1-(4-benzoylpiperidino)-2-(2,3-dihydro-1,4-benzodioxin-6-ylthio)ethanone Formula: C22H23NO4S MolecularWeight: 397.48732

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)C2=CC=CC=C2)C(=O)CSC3=CC4=C(C=C3)OCCO4

Isomeric SMILES

C1CN(CCC1C(=O)C2=CC=CC=C2)C(=O)CSC3=CC4=C(C=C3)OCCO4

InChI

InChI=1S/C22H23NO4S/c24-21(15-28-18-6-7-19-20(14-18)27-13-12-26-19)23-10-8-17(9-11-23)22(25)16-4-2-1-3-5-16/h1-7,14,17H,8-13,15H2