1-[4-[2-oxidanyl-3-[4-(phenylsulfonyl)piperazin-1-yl]propoxy]phenyl]propan-1-one

Systemtic Name: 1-[4-[2-oxidanyl-3-[4-(phenylsulfonyl)piperazin-1-yl]propoxy]phenyl]propan-1-one Openeye Name: 1-[4-[3-[4-(benzenesulfonyl)piperazin-1-yl]-2-hydroxy-propoxy]phenyl]propan-1-one CAS Name: 1-[4-[3-[4-(benzenesulfonyl)-1-piperazinyl]-2-hydroxypropoxy]phenyl]-1-propanone IUPAC Name: 1-[4-[3-[4-(benzenesulfonyl)piperazin-1-yl]-2-hydroxypropoxy]phenyl]propan-1-one Traditional Name: 1-[4-[3-(4-besylpiperazino)-2-hydroxy-propoxy]phenyl]propan-1-one Formula: C22H28N2O5S MolecularWeight: 432.53312

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)C1=CC=C(C=C1)OCC(CN2CCN(CC2)S(=O)(=O)C3=CC=CC=C3)O

Isomeric SMILES

CCC(=O)C1=CC=C(C=C1)OCC(CN2CCN(CC2)S(=O)(=O)C3=CC=CC=C3)O

InChI

InChI=1S/C22H28N2O5S/c1-2-22(26)18-8-10-20(11-9-18)29-17-19(25)16-23-12-14-24(15-13-23)30(27,28)21-6-4-3-5-7-21/h3-11,19,25H,2,12-17H2,1H3