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

Systemtic Name: 2-methylsulfonyl-1-[4-(phenylmethyl)piperazin-1-yl]propan-1-one Openeye Name: 1-(4-benzylpiperazin-1-yl)-2-methylsulfonyl-propan-1-one CAS Name: 2-methylsulfonyl-1-[4-(phenylmethyl)-1-piperazinyl]-1-propanone IUPAC Name: 1-(4-benzylpiperazin-1-yl)-2-methylsulfonylpropan-1-one Traditional Name: 1-(4-benzylpiperazino)-2-mesyl-propan-1-one Formula: C15H22N2O3S MolecularWeight: 310.41178

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N1CCN(CC1)CC2=CC=CC=C2)S(=O)(=O)C

Isomeric SMILES

CC(C(=O)N1CCN(CC1)CC2=CC=CC=C2)S(=O)(=O)C

InChI

InChI=1S/C15H22N2O3S/c1-13(21(2,19)20)15(18)17-10-8-16(9-11-17)12-14-6-4-3-5-7-14/h3-7,13H,8-12H2,1-2H3