1-(4-methylsulfonylpiperazin-1-yl)-2-(4-nitrophenyl)ethanone

Systemtic Name: 1-(4-methylsulfonylpiperazin-1-yl)-2-(4-nitrophenyl)ethanone Openeye Name: 1-(4-methylsulfonylpiperazin-1-yl)-2-(4-nitrophenyl)ethanone CAS Name: 1-(4-methylsulfonyl-1-piperazinyl)-2-(4-nitrophenyl)ethanone IUPAC Name: 1-(4-methylsulfonylpiperazin-1-yl)-2-(4-nitrophenyl)ethanone Traditional Name: 1-(4-mesylpiperazino)-2-(4-nitrophenyl)ethanone Formula: C13H17N3O5S MolecularWeight: 327.35618

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)N1CCN(CC1)C(=O)CC2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

CS(=O)(=O)N1CCN(CC1)C(=O)CC2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C13H17N3O5S/c1-22(20,21)15-8-6-14(7-9-15)13(17)10-11-2-4-12(5-3-11)16(18)19/h2-5H,6-10H2,1H3