1-methyl-4-[2-(4-methylphenyl)sulfonylethyl]piperazin-1-ium

Systemtic Name: 1-methyl-4-[2-(4-methylphenyl)sulfonylethyl]piperazin-1-ium Openeye Name: 1-methyl-4-[2-(p-tolylsulfonyl)ethyl]piperazin-1-ium CAS Name: 1-methyl-4-[2-(4-methylphenyl)sulfonylethyl]piperazin-1-ium IUPAC Name: 1-methyl-4-[2-(4-methylphenyl)sulfonylethyl]piperazin-1-ium Traditional Name: 1-methyl-4-(2-tosylethyl)piperazin-1-ium Formula: C14H23N2O2S+ MolecularWeight: 283.40962

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)CCN2CC[NH+](CC2)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)CCN2CC[NH+](CC2)C

InChI

InChI=1S/C14H22N2O2S/c1-13-3-5-14(6-4-13)19(17,18)12-11-16-9-7-15(2)8-10-16/h3-6H,7-12H2,1-2H3/p+1