(3S,5S)-1-(2,5-dimethylphenyl)sulfonyl-3,5-dimethyl-piperazin-4-ium

Systemtic Name: (3S,5S)-1-(2,5-dimethylphenyl)sulfonyl-3,5-dimethyl-piperazin-4-ium Openeye Name: (3S,5S)-1-(2,5-dimethylphenyl)sulfonyl-3,5-dimethyl-piperazin-4-ium CAS Name: (3S,5S)-1-(2,5-dimethylphenyl)sulfonyl-3,5-dimethylpiperazin-4-ium IUPAC Name: (3S,5S)-1-(2,5-dimethylphenyl)sulfonyl-3,5-dimethylpiperazin-4-ium Traditional Name: (3S,5S)-1-(2,5-dimethylphenyl)sulfonyl-3,5-dimethyl-piperazin-4-ium Formula: C14H23N2O2S+ MolecularWeight: 283.40962

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H22N2O2S/c1-10-5-6-11(2)14(7-10)19(17,18)16-8-12(3)15-13(4)9-16/h5-7,12-13,15H,8-9H2,1-4H3/p+1/t12-,13-/m0/s1