1-(2,5-dimethylphenyl)sulfonylpiperazin-4-ium

Systemtic Name: 1-(2,5-dimethylphenyl)sulfonylpiperazin-4-ium Openeye Name: 1-(2,5-dimethylphenyl)sulfonylpiperazin-4-ium CAS Name: 1-(2,5-dimethylphenyl)sulfonylpiperazin-4-ium IUPAC Name: 1-(2,5-dimethylphenyl)sulfonylpiperazin-4-ium Traditional Name: 1-(2,5-dimethylphenyl)sulfonylpiperazin-4-ium Formula: C12H19N2O2S+ MolecularWeight: 255.35646

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)S(=O)(=O)N2CC[NH2+]CC2

Isomeric SMILES

CC1=CC(=C(C=C1)C)S(=O)(=O)N2CC[NH2+]CC2

InChI

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