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

Systemtic Name: 2-methyl-1-[4-(phenylsulfonyl)piperazin-1-yl]propan-1-one Openeye Name: 1-[4-(benzenesulfonyl)piperazin-1-yl]-2-methyl-propan-1-one CAS Name: 1-[4-(benzenesulfonyl)-1-piperazinyl]-2-methyl-1-propanone IUPAC Name: 1-[4-(benzenesulfonyl)piperazin-1-yl]-2-methylpropan-1-one Traditional Name: 1-(4-besylpiperazino)-2-methyl-propan-1-one Formula: C14H20N2O3S MolecularWeight: 296.3852

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H20N2O3S/c1-12(2)14(17)15-8-10-16(11-9-15)20(18,19)13-6-4-3-5-7-13/h3-7,12H,8-11H2,1-2H3