1-methyl-4-[(2S)-1-(4-methylphenyl)sulfonylpropan-2-yl]piperazin-1-ium

Systemtic Name: 1-methyl-4-[(2S)-1-(4-methylphenyl)sulfonylpropan-2-yl]piperazin-1-ium Openeye Name: 1-methyl-4-[(1S)-1-methyl-2-(p-tolylsulfonyl)ethyl]piperazin-1-ium CAS Name: 1-methyl-4-[(2S)-1-(4-methylphenyl)sulfonylpropan-2-yl]piperazin-1-ium IUPAC Name: 1-methyl-4-[(2S)-1-(4-methylphenyl)sulfonylpropan-2-yl]piperazin-1-ium Traditional Name: 1-methyl-4-[(1S)-1-methyl-2-tosyl-ethyl]piperazin-1-ium Formula: C15H25N2O2S+ MolecularWeight: 297.4362

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H24N2O2S/c1-13-4-6-15(7-5-13)20(18,19)12-14(2)17-10-8-16(3)9-11-17/h4-7,14H,8-12H2,1-3H3/p+1/t14-/m0/s1