1-methyl-4-(phenylsulfonyl)piperazin-1-ium

Systemtic Name: 1-methyl-4-(phenylsulfonyl)piperazin-1-ium Openeye Name: 1-(benzenesulfonyl)-4-methyl-piperazin-4-ium CAS Name: 1-(benzenesulfonyl)-4-methylpiperazin-4-ium IUPAC Name: 1-(benzenesulfonyl)-4-methylpiperazin-4-ium Traditional Name: 1-besyl-4-methyl-piperazin-4-ium Formula: C11H17N2O2S+ MolecularWeight: 241.32988

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)S(=O)(=O)C2=CC=CC=C2

Isomeric SMILES

C[NH+]1CCN(CC1)S(=O)(=O)C2=CC=CC=C2

InChI

InChI=1S/C11H16N2O2S/c1-12-7-9-13(10-8-12)16(14,15)11-5-3-2-4-6-11/h2-6H,7-10H2,1H3/p+1