1-methyl-4-(4-methylphenyl)sulfonyl-piperazin-1-ium

Systemtic Name: 1-methyl-4-(4-methylphenyl)sulfonyl-piperazin-1-ium Openeye Name: 1-methyl-4-(p-tolylsulfonyl)piperazin-1-ium CAS Name: 1-methyl-4-(4-methylphenyl)sulfonylpiperazin-1-ium IUPAC Name: 1-methyl-4-(4-methylphenyl)sulfonylpiperazin-1-ium Traditional Name: 1-methyl-4-tosyl-piperazin-1-ium Formula: C12H19N2O2S+ MolecularWeight: 255.35646

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CC[NH+](CC2)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CC[NH+](CC2)C

InChI

InChI=1S/C12H18N2O2S/c1-11-3-5-12(6-4-11)17(15,16)14-9-7-13(2)8-10-14/h3-6H,7-10H2,1-2H3/p+1