1-[4-(phenylsulfonyl)piperazin-1-yl]propan-2-one

Systemtic Name: 1-[4-(phenylsulfonyl)piperazin-1-yl]propan-2-one Openeye Name: 1-[4-(benzenesulfonyl)piperazin-1-yl]propan-2-one CAS Name: 1-[4-(benzenesulfonyl)-1-piperazinyl]-2-propanone IUPAC Name: 1-[4-(benzenesulfonyl)piperazin-1-yl]propan-2-one Traditional Name: 1-(4-besylpiperazino)acetone Formula: C13H18N2O3S MolecularWeight: 282.35862

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)CN1CCN(CC1)S(=O)(=O)C2=CC=CC=C2

Isomeric SMILES

CC(=O)CN1CCN(CC1)S(=O)(=O)C2=CC=CC=C2

InChI

InChI=1S/C13H18N2O3S/c1-12(16)11-14-7-9-15(10-8-14)19(17,18)13-5-3-2-4-6-13/h2-6H,7-11H2,1H3