1-[4-(phenylsulfonyl)piperazin-1-yl]pentan-1-one

Systemtic Name: 1-[4-(phenylsulfonyl)piperazin-1-yl]pentan-1-one Openeye Name: 1-[4-(benzenesulfonyl)piperazin-1-yl]pentan-1-one CAS Name: 1-[4-(benzenesulfonyl)-1-piperazinyl]-1-pentanone IUPAC Name: 1-[4-(benzenesulfonyl)piperazin-1-yl]pentan-1-one Traditional Name: 1-(4-besylpiperazino)pentan-1-one Formula: C15H22N2O3S MolecularWeight: 310.41178

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(=O)N1CCN(CC1)S(=O)(=O)C2=CC=CC=C2

Isomeric SMILES

CCCCC(=O)N1CCN(CC1)S(=O)(=O)C2=CC=CC=C2

InChI

InChI=1S/C15H22N2O3S/c1-2-3-9-15(18)16-10-12-17(13-11-16)21(19,20)14-7-5-4-6-8-14/h4-8H,2-3,9-13H2,1H3