1-(4-methylphenyl)sulfonyl-4-propyl-piperazin-4-ium

Systemtic Name: 1-(4-methylphenyl)sulfonyl-4-propyl-piperazin-4-ium Openeye Name: 1-propyl-4-(p-tolylsulfonyl)piperazin-1-ium CAS Name: 1-(4-methylphenyl)sulfonyl-4-propylpiperazin-4-ium IUPAC Name: 1-(4-methylphenyl)sulfonyl-4-propylpiperazin-4-ium Traditional Name: 1-propyl-4-tosyl-piperazin-1-ium Formula: C14H23N2O2S+ MolecularWeight: 283.40962

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Descriptors Computed from Structure

Canonical SMILES:

CCC[NH+]1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)C

Isomeric SMILES

CCC[NH+]1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)C

InChI

InChI=1S/C14H22N2O2S/c1-3-8-15-9-11-16(12-10-15)19(17,18)14-6-4-13(2)5-7-14/h4-7H,3,8-12H2,1-2H3/p+1