(3S,5S)-3,5-dimethyl-1-(phenylsulfonyl)piperazin-4-ium

Systemtic Name: (3S,5S)-3,5-dimethyl-1-(phenylsulfonyl)piperazin-4-ium Openeye Name: (3S,5S)-1-(benzenesulfonyl)-3,5-dimethyl-piperazin-4-ium CAS Name: (3S,5S)-1-(benzenesulfonyl)-3,5-dimethylpiperazin-4-ium IUPAC Name: (3S,5S)-1-(benzenesulfonyl)-3,5-dimethylpiperazin-4-ium Traditional Name: (3S,5S)-1-besyl-3,5-dimethyl-piperazin-4-ium Formula: C12H19N2O2S+ MolecularWeight: 255.35646

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CC([NH2+]1)C)S(=O)(=O)C2=CC=CC=C2

Isomeric SMILES

C[C@H]1CN(C[C@@H]([NH2+]1)C)S(=O)(=O)C2=CC=CC=C2

InChI

InChI=1S/C12H18N2O2S/c1-10-8-14(9-11(2)13-10)17(15,16)12-6-4-3-5-7-12/h3-7,10-11,13H,8-9H2,1-2H3/p+1/t10-,11-/m0/s1